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nanoparticlesims/growth_Melting_Silver_ICO_3269/freezeSims/run_60/freeze.log

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main_MD> Reading input file
read_input> Process type: freezing
Read_input> Process caloric with a T-change of 25.000000000000000 [K] and a rate of 9.9999999999999992E+022 [K/ns]
read_input> Input for metadynamics has been read
read_input> Metadynamics has not been chosen.
read_input> Reading initial positions fromtoFreeze_60.xyz
read_input> Finish reading initial positions
read_input> Validating positions
read_input> Initializing random number generator
read_input> Checking program
read_rgl> START READING FILE ../pot.pot
read_rgl>> END READING FILE ../pot.pot
READ_RGL>> atomic speciesAgAg imet1 4 imet2 4
READ_RGL>> atomic radius 1.4450000999999999 1.4450000999999999
read_rgl> PARAMETERS SELECTION
FOR IMET1 :: Ag 4
ECOH :: 2.9500000000000002 A :: 0.10308871000000000 QSI :: 1.1895434899999999
p :: 10.850000000000000 q :: 3.1800000000000002
ATOMIC RADIUS :: 1.4450000999999999
choice_pot> values:
frac = 0.12062503764379931 arete = 4.0870774781009569
choice_pot> mass is== 108.00000000000000 for elem1=
read_input> ntipo1 = 60 ntipo2 = 0
read_input> Finish reading input
main_MD> Allocating global variables
main_MD> Number of outputs that will be created: 1550
main_MD> Size of nv and nvoiz: 60 6000
main_MD> Size of nv and nvoiz: 60 6000
main_MD> Number of time-steps (npas) = 50000
main_MD> Number of CVs (num_cv) = 1
main_MD> Max allowed number of atoms = 2900
main_MD> Max number of atoms = 60
main_MD> Consider changing parameter nsiz in module_parameters.f90 for performance
main_MD> collvar_wanted = F
main_MD> INPUT AND POTENTIAL FILE READING IS DONE
main_MD> THERMALIZATION IS STARTING
init> 3.7260178672507041E-002 -1.4418229358756680E-002 4.6272069231875438E-003 initial drift of cluster / NP1 for coalescence
init> 0.28960345599594034 0.29069595779364837 0.28733487565060128 scaling for velocity /for coalescence NP1
init.f90 > facguy = 3.5300061358286630E-003
preparo> IN BIGVOI : LIMIT 1.2247448652052084 1.2247448652052084 1.2247448652052084
preparo> END t=0 TIME STEP
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.57389 3.54834 1.28915
force_rgl> df(natom) -1.13778 -2.76537 2.54518
preparo> THERMALIZATION PROCESS AT 1081.0321316142606
preparo> TOTAL ENERGY, KINETIC EN., POT. ENERGY, DELTA
5000 -131.06653874147671 9.6222790340919548 -140.68881777556865 6.4000656578755487E-004
preparo> END THERMALISATION ON NPAST DEFINE IN PARACLUSTER MODULE
main_MD> Time-loop is starting for freezing
main_MD> Now the computation of EXECUTION TIME starts
main_MD> Running from loop 1 to 31
FREEZING PROCESS: loop number 1 T-loop= 1056.0000000000000
main_MD> interactions number 1 at Temperature= 1056.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -8.48909 -2.85201 -5.86849
force_rgl> df(natom) 2.82108 -0.05158 -0.20065
5.0000 -140.81211 -133.56900 7.24311 2.96022 -131.63118 1136.22093
10.0000 -142.26448 -133.53619 8.72829 2.82877 -133.64571 1039.77352
15.0000 -140.37592 -132.36835 8.00757 2.88674 -132.75735 1080.40253
20.0000 -141.42553 -132.93100 8.49453 2.88548 -132.77656 1104.84613
25.0000 -141.00421 -131.96537 9.03884 2.91291 -132.35614 1078.67265
30.0000 -142.23696 -133.93789 8.29907 2.92197 -132.21738 1098.73456
35.0000 -140.70641 -132.36199 8.34442 2.85312 -133.27260 1062.47270
40.0000 -142.83499 -134.37030 8.46469 2.84435 -133.40702 1072.27002
45.0000 -141.47891 -133.72814 7.75077 2.81346 -133.88038 1071.07781
50.0000 -140.85516 -133.33576 7.51940 2.83735 -133.51424 1059.55545
55.0000 -141.52554 -132.87091 8.65463 2.78384 -134.33427 1043.60864
60.0000 -139.72993 -132.38432 7.34561 2.90078 -132.54209 1124.94332
65.0000 -140.07886 -131.55154 8.52732 2.94078 -131.92904 1129.68191
70.0000 -139.42288 -131.11859 8.30428 2.94352 -131.88700 1146.78270
75.0000 -141.37383 -133.22271 8.15112 2.92347 -132.19433 1130.07012
80.0000 -141.61659 -131.56410 10.05249 2.92451 -132.17844 1114.55725
85.0000 -141.42573 -133.59633 7.82940 2.85890 -133.18402 1084.58954
90.0000 -141.85502 -133.17260 8.68242 2.84229 -133.43847 1070.90520
95.0000 -141.31536 -134.00494 7.31043 2.82723 -133.66927 1047.36777
100.0000 -142.47808 -134.56262 7.91546 2.75953 -134.70695 1029.94695
105.0000 -141.89939 -132.28755 9.61185 2.84139 -133.45228 1063.45722
110.0000 -142.28993 -133.47171 8.81822 2.88495 -132.78468 1116.42807
115.0000 -141.30469 -134.16419 7.14050 2.84482 -133.39978 1060.71933
120.0000 -141.45570 -132.58811 8.86759 2.85836 -133.19219 1071.80349
125.0000 -141.13814 -132.52802 8.61012 2.84479 -133.40024 1062.12131
130.0000 -140.80379 -131.56856 9.23523 2.85279 -133.27756 1052.45786
135.0000 -143.41031 -133.45936 9.95096 2.89806 -132.58385 1117.83793
140.0000 -141.05483 -133.55805 7.49678 2.83542 -133.54376 1091.38924
145.0000 -141.37658 -131.98592 9.39066 2.88140 -132.83915 1085.20523
150.0000 -141.82218 -133.79488 8.02730 2.93247 -132.05639 1165.91671
155.0000 -143.71240 -135.77462 7.93778 2.72103 -135.29702 1000.49622
160.0000 -141.82206 -134.05456 7.76750 2.74910 -134.86676 1015.90679
165.0000 -143.26291 -135.06320 8.19971 2.78050 -134.38553 1021.42509
170.0000 -144.04143 -135.03004 9.01139 2.69598 -135.68097 982.95066
175.0000 -142.35111 -134.40592 7.94519 2.78064 -134.38337 1000.71606
180.0000 -141.35174 -133.46971 7.88202 2.78893 -134.25636 1003.95003
185.0000 -141.70265 -133.05693 8.64573 2.86290 -133.12265 1096.98075
190.0000 -141.95872 -133.57963 8.37909 2.86962 -133.01968 1091.17441
195.0000 -142.46833 -133.97261 8.49572 2.86421 -133.10264 1070.04989
200.0000 -142.57755 -133.30694 9.27061 2.81173 -133.90695 1053.48256
205.0000 -141.17373 -133.76906 7.40467 2.79149 -134.21712 1045.34185
210.0000 -141.55476 -132.75134 8.80342 2.83525 -133.54646 1050.62026
215.0000 -142.35461 -133.87877 8.47584 2.88629 -132.76425 1105.22642
220.0000 -143.47931 -136.12308 7.35624 2.73473 -135.08701 1008.24629
225.0000 -143.39710 -135.95255 7.44455 2.67959 -135.93209 944.34181
230.0000 -142.17745 -134.19324 7.98421 2.72950 -135.16714 1005.46255
235.0000 -142.08979 -133.42181 8.66798 2.83268 -133.58576 1059.46077
240.0000 -142.96130 -134.87448 8.08682 2.86749 -133.05233 1059.87716
245.0000 -143.09174 -134.28372 8.80802 2.78889 -134.25691 1035.11618
250.0000 -141.78688 -134.48653 7.30036 2.80050 -134.07905 1046.00597
FREEZING PROCESS: loop number 2 T-loop= 1031.0000000000000
main_MD> interactions number 2 at Temperature= 1031.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.67655 1.78054 -1.91936
force_rgl> df(natom) 0.05108 1.65239 -2.36362
255.0000 -144.30252 -136.79931 7.50320 2.67589 -135.98880 947.90094
260.0000 -142.00354 -133.30841 8.69513 2.69490 -135.69743 963.51944
265.0000 -141.31997 -133.96963 7.35034 2.84152 -133.45028 1051.57942
270.0000 -144.76023 -136.69430 8.06593 2.72387 -135.25348 963.31340
275.0000 -142.24737 -134.36534 7.88203 2.72446 -135.24443 966.91073
280.0000 -141.26112 -133.17340 8.08772 2.93420 -132.02989 1115.28815
285.0000 -143.05115 -134.77848 8.27267 2.79557 -134.15454 1012.15191
290.0000 -143.09705 -134.69995 8.39710 2.77931 -134.40380 1048.35181
295.0000 -142.96849 -134.61162 8.35686 2.80931 -133.94394 1052.19114
300.0000 -142.26904 -135.04271 7.22634 2.72766 -135.19530 987.18212
305.0000 -142.04134 -135.02150 7.01984 2.72256 -135.27351 965.15629
310.0000 -143.32963 -134.97967 8.34996 2.72420 -135.24837 963.53270
315.0000 -140.46091 -133.11080 7.35011 2.82817 -133.65490 1051.33574
320.0000 -142.76337 -135.28557 7.47780 2.81579 -133.84469 1035.86461
325.0000 -142.82185 -135.02513 7.79672 2.74199 -134.97569 991.44935
330.0000 -142.61639 -134.47291 8.14348 2.74703 -134.89849 1013.39550
335.0000 -141.32372 -134.60244 6.72127 2.73068 -135.14910 996.68941
340.0000 -141.45335 -133.10673 8.34662 2.84094 -133.45921 1069.56095
345.0000 -141.89079 -134.58343 7.30735 2.87079 -133.00174 1045.27074
350.0000 -141.24980 -133.23143 8.01837 2.85044 -133.31362 1048.16329
355.0000 -140.92706 -131.65009 9.27697 2.83760 -133.51042 1089.84357
360.0000 -142.01089 -133.91220 8.09869 2.91898 -132.26320 1107.18787
365.0000 -143.52677 -134.14380 9.38297 2.82913 -133.64026 1092.61038
370.0000 -143.24131 -136.09736 7.14395 2.73613 -135.06553 969.85091
375.0000 -144.57632 -137.67862 6.89770 2.65834 -136.25777 949.90948
380.0000 -144.05252 -137.93874 6.11378 2.54825 -137.94496 816.90932
385.0000 -144.65182 -137.24279 7.40903 2.53164 -138.19958 826.29312
390.0000 -144.80280 -138.34832 6.45447 2.57167 -137.58613 894.35322
395.0000 -142.47194 -134.98576 7.48618 2.65448 -136.31692 942.65030
400.0000 -142.95451 -136.45658 6.49793 2.76525 -134.61925 1006.41481
405.0000 -142.01997 -135.51051 6.50946 2.67543 -135.99583 966.47180
410.0000 -143.65647 -136.84346 6.81300 2.61902 -136.86044 897.32956
415.0000 -143.30184 -134.37986 8.92198 2.70839 -135.49071 986.38834
420.0000 -143.45090 -135.57417 7.87674 2.74140 -134.98477 1004.96340
425.0000 -142.61778 -134.18310 8.43469 2.74887 -134.87024 986.10003
430.0000 -143.10561 -135.13066 7.97496 2.78076 -134.38152 998.07882
435.0000 -143.79511 -135.29781 8.49731 2.72986 -135.16161 1006.56437
440.0000 -143.27839 -135.80566 7.47273 2.67044 -136.07233 934.96273
445.0000 -141.77890 -134.82548 6.95342 2.72741 -135.19917 970.58485
450.0000 -142.65528 -135.06236 7.59292 2.79132 -134.21967 996.00927
455.0000 -142.08094 -134.38970 7.69124 2.75273 -134.81110 1006.85160
460.0000 -142.29294 -132.55918 9.73376 2.86391 -133.10722 1086.10835
465.0000 -142.30251 -132.70384 9.59867 2.87934 -132.87067 1102.76745
470.0000 -142.61580 -134.44286 8.17293 2.85557 -133.23503 1067.27642
475.0000 -143.98619 -135.84830 8.13789 2.70650 -135.51967 1008.72222
480.0000 -142.46120 -134.54396 7.91725 2.77667 -134.44417 1052.23420
485.0000 -142.25665 -134.59483 7.66182 2.77566 -134.45964 1006.37063
490.0000 -144.00631 -135.03740 8.96892 2.70334 -135.56808 942.14733
495.0000 -142.61784 -134.68644 7.93140 2.72853 -135.18198 1002.72593
500.0000 -142.98379 -132.14338 10.84041 2.85499 -133.24384 1075.82595
FREEZING PROCESS: loop number 3 T-loop= 1006.0000000000000
main_MD> interactions number 3 at Temperature= 1006.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.38747 1.86929 -0.21406
force_rgl> df(natom) -0.48534 -1.74186 0.51875
505.0000 -142.07104 -133.57929 8.49175 2.84910 -133.33420 1050.41704
510.0000 -141.55396 -133.88184 7.67212 2.79012 -134.23808 1013.83519
515.0000 -142.40499 -135.40200 7.00300 2.79016 -134.23753 1013.61959
520.0000 -142.09319 -133.84492 8.24827 2.76121 -134.68122 1000.45846
525.0000 -142.13808 -134.67685 7.46123 2.80831 -133.95934 1050.19240
530.0000 -143.44997 -135.84170 7.60827 2.71897 -135.32860 974.72511
535.0000 -142.08962 -134.62634 7.46328 2.74506 -134.92876 973.41784
540.0000 -143.13489 -136.09001 7.04488 2.73005 -135.15875 998.33676
545.0000 -141.46322 -134.19560 7.26762 2.78559 -134.30746 1064.82905
550.0000 -141.38099 -132.90174 8.47926 2.77300 -134.50042 1012.73332
555.0000 -141.60286 -134.40944 7.19342 2.81782 -133.81350 1051.13504
560.0000 -143.15680 -134.64630 8.51050 2.76986 -134.54855 1012.68198
565.0000 -142.97643 -135.14282 7.83361 2.74549 -134.92204 991.76489
570.0000 -141.66572 -133.61334 8.05237 2.79834 -134.11216 1053.00519
575.0000 -141.39497 -134.22899 7.16597 2.80750 -133.97169 1036.97396
580.0000 -142.91309 -134.68785 8.22524 2.75778 -134.73379 1055.16820
585.0000 -143.56678 -136.33461 7.23217 2.72639 -135.21481 978.20386
590.0000 -142.80031 -135.86699 6.93333 2.66208 -136.20044 931.60393
595.0000 -141.15568 -133.18851 7.96718 2.78255 -134.35412 1042.90969
600.0000 -142.70726 -134.17716 8.53010 2.80155 -134.06288 1071.32603
605.0000 -143.05219 -134.49497 8.55721 2.77772 -134.42809 1015.23049
610.0000 -141.69659 -133.69596 8.00062 2.83377 -133.56913 1030.12790
615.0000 -140.49758 -132.73217 7.76542 2.84863 -133.34129 1085.67392
620.0000 -142.21241 -134.06551 8.14690 2.82451 -133.71104 1055.33920
625.0000 -140.28988 -133.36982 6.92006 2.84132 -133.45347 1082.79532
630.0000 -142.89039 -135.79764 7.09275 2.71358 -135.41118 989.33553
635.0000 -143.76337 -136.64150 7.12187 2.68502 -135.84894 965.13006
640.0000 -144.46438 -136.73956 7.72482 2.61252 -136.96005 927.17791
645.0000 -144.61586 -135.83221 8.78364 2.67650 -135.97948 973.99186
650.0000 -143.18857 -136.63825 6.55032 2.65090 -136.37175 920.87457
655.0000 -145.09366 -136.52498 8.56868 2.63130 -136.67221 940.62141
660.0000 -143.69261 -135.08540 8.60720 2.66348 -136.17900 959.56945
665.0000 -143.33227 -136.10355 7.22873 2.69541 -135.68961 950.09699
670.0000 -143.10186 -135.75655 7.34531 2.69613 -135.67859 969.53475
675.0000 -142.24202 -135.04339 7.19863 2.69611 -135.67898 961.80791
680.0000 -142.39376 -134.84642 7.54734 2.71152 -135.44279 988.83366
685.0000 -142.71646 -133.56425 9.15222 2.79100 -134.22465 1038.56328
690.0000 -142.40306 -133.74919 8.65387 2.79668 -134.13756 1073.56142
695.0000 -140.24393 -131.47007 8.77386 2.82096 -133.76538 1070.28960
700.0000 -142.33642 -134.37716 7.95927 2.84182 -133.44578 1071.60724
705.0000 -142.05799 -134.08981 7.96818 2.78253 -134.35444 1017.44146
710.0000 -141.77946 -132.94329 8.83617 2.80236 -134.05056 1060.67433
715.0000 -141.56710 -132.04874 9.51836 2.90707 -132.44577 1117.16579
720.0000 -142.85859 -135.31127 7.54732 2.76672 -134.59678 1007.51987
725.0000 -144.97006 -136.86980 8.10026 2.66752 -136.11705 951.21954
730.0000 -144.23464 -136.18688 8.04776 2.68022 -135.92251 967.39577
735.0000 -142.31913 -134.70010 7.61902 2.72946 -135.16781 996.38581
740.0000 -142.91124 -134.96391 7.94733 2.69468 -135.70088 981.73095
745.0000 -142.81412 -134.44315 8.37097 2.77143 -134.52454 1018.57479
750.0000 -143.21767 -135.61048 7.60719 2.75411 -134.79002 989.93494
FREEZING PROCESS: loop number 4 T-loop= 981.00000000000000
main_MD> interactions number 4 at Temperature= 981.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.98422 2.26553 -1.80558
force_rgl> df(natom) -2.39414 2.84452 -1.21408
755.0000 -144.06211 -135.07104 8.99107 2.70749 -135.50446 953.53995
760.0000 -141.63305 -134.82765 6.80540 2.76223 -134.66560 1018.03218
765.0000 -144.28560 -136.00558 8.28001 2.68815 -135.80085 982.92866
770.0000 -143.18296 -134.80150 8.38147 2.79957 -134.09326 1045.79249
775.0000 -141.30681 -135.00824 6.29857 2.76308 -134.65254 1019.70557
780.0000 -142.55976 -134.07318 8.48658 2.79134 -134.21945 1032.49527
785.0000 -142.94616 -133.95471 8.99145 2.77882 -134.41124 1041.34872
790.0000 -142.81144 -135.62893 7.18252 2.75758 -134.73679 1014.74342
795.0000 -141.70315 -134.33038 7.37277 2.77421 -134.48198 1040.54025
800.0000 -143.28919 -136.14189 7.14729 2.71269 -135.42473 978.95403
805.0000 -143.16663 -135.26688 7.89975 2.74062 -134.99672 958.38547
810.0000 -144.39212 -136.14242 8.24971 2.71723 -135.35524 975.15473
815.0000 -142.51356 -134.67675 7.83681 2.67781 -135.95937 946.76399
820.0000 -141.37432 -134.25648 7.11785 2.76779 -134.58034 1036.83625
825.0000 -140.07244 -132.77900 7.29344 2.86803 -133.04403 1056.80265
830.0000 -141.44429 -134.46036 6.98392 2.89576 -132.61900 1137.33848
835.0000 -142.89828 -135.59607 7.30221 2.75420 -134.78862 999.61703
840.0000 -142.28882 -135.19972 7.08910 2.69594 -135.68153 936.67385
845.0000 -140.81094 -132.08469 8.72625 2.84741 -133.36013 1073.82278
850.0000 -142.75844 -134.34986 8.40858 2.85882 -133.18521 1058.87544
855.0000 -142.07926 -133.21451 8.86475 2.78744 -134.27912 1002.19194
860.0000 -142.53674 -134.58089 7.95585 2.83947 -133.48180 1047.90086
865.0000 -144.09161 -137.29660 6.79501 2.65077 -136.37378 941.48188
870.0000 -143.89972 -136.32450 7.57522 2.68721 -135.81524 1017.62351
875.0000 -142.10369 -135.21820 6.88550 2.71022 -135.46272 958.60718
880.0000 -142.90861 -135.38469 7.52393 2.70424 -135.55438 982.36496
885.0000 -143.18532 -134.87963 8.30570 2.73920 -135.01854 999.75222
890.0000 -143.19510 -136.22332 6.97178 2.69065 -135.76254 968.50834
895.0000 -143.33437 -137.18482 6.14955 2.61480 -136.92506 902.78567
900.0000 -143.49877 -135.11839 8.38038 2.63485 -136.61778 915.25605
905.0000 -143.33541 -136.62733 6.70808 2.62861 -136.71339 895.91155
910.0000 -141.71457 -135.27494 6.43963 2.68900 -135.78792 934.41260
915.0000 -143.49275 -134.72737 8.76538 2.74603 -134.91379 987.30981
920.0000 -140.99262 -133.13169 7.86092 2.81627 -133.83726 1055.65220
925.0000 -143.09452 -135.47549 7.61903 2.84812 -133.34924 1061.40779
930.0000 -142.91191 -136.51034 6.40157 2.65938 -136.24177 938.87018
935.0000 -141.51607 -134.01648 7.49959 2.75863 -134.72075 1034.60975
940.0000 -143.58169 -135.73973 7.84196 2.70841 -135.49044 946.85466
945.0000 -142.05521 -134.49375 7.56146 2.75472 -134.78069 986.66919
950.0000 -141.70875 -134.91168 6.79707 2.78553 -134.30843 986.46365
955.0000 -141.24165 -133.77900 7.46265 2.83107 -133.61049 1040.91106
960.0000 -139.86986 -130.57728 9.29258 2.92642 -132.14908 1117.30819
965.0000 -142.09368 -133.47110 8.62259 2.94857 -131.80961 1150.24946
970.0000 -144.24762 -136.62042 7.62720 2.73968 -135.01111 979.02770
975.0000 -142.41713 -134.87503 7.54210 2.68448 -135.85708 973.91552
980.0000 -141.95923 -134.97303 6.98620 2.73822 -135.03359 985.30702
985.0000 -143.91768 -137.09809 6.81959 2.66570 -136.14490 911.85589
990.0000 -143.78963 -136.60355 7.18608 2.54834 -137.94369 855.90673
995.0000 -144.76042 -138.13829 6.62213 2.57929 -137.46938 906.89947
1000.0000 -145.05124 -138.71162 6.33963 2.52491 -138.30278 826.12310
FREEZING PROCESS: loop number 5 T-loop= 956.00000000000000
main_MD> interactions number 5 at Temperature= 956.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.77805 -2.54632 0.10396
force_rgl> df(natom) 0.39766 3.36768 -0.36883
1005.0000 -144.21024 -136.14053 8.06971 2.61470 -136.92662 921.52311
1010.0000 -143.94604 -136.74915 7.19689 2.62717 -136.73552 910.79318
1015.0000 -144.90186 -138.69496 6.20691 2.61266 -136.95795 914.82391
1020.0000 -142.17578 -134.86064 7.31514 2.61037 -136.99305 927.85461
1025.0000 -142.96573 -134.77725 8.18848 2.72314 -135.26471 1020.58160
1030.0000 -144.07062 -136.27671 7.79391 2.71823 -135.33992 966.01996
1035.0000 -143.07075 -136.04168 7.02907 2.64736 -136.42608 943.39068
1040.0000 -142.95688 -134.80664 8.15024 2.66624 -136.13668 950.97496
1045.0000 -142.03204 -135.19462 6.83742 2.73787 -135.03885 1002.95450
1050.0000 -142.37155 -133.75307 8.61848 2.73242 -135.12244 1019.62855
1055.0000 -140.54654 -132.84637 7.70017 2.85535 -133.23840 1091.23969
1060.0000 -141.95800 -134.53117 7.42683 2.79639 -134.14202 1029.34258
1065.0000 -143.51544 -134.58465 8.93078 2.79211 -134.20759 1019.22971
1070.0000 -141.52754 -134.04584 7.48170 2.80940 -133.94259 1038.91124
1075.0000 -140.64075 -133.01171 7.62904 2.82410 -133.71728 1043.24540
1080.0000 -141.91619 -134.24931 7.66688 2.82626 -133.68414 1078.53640
1085.0000 -142.76880 -135.85340 6.91540 2.67776 -135.96010 929.47012
1090.0000 -144.17113 -135.15103 9.02010 2.64111 -136.52191 938.46603
1095.0000 -143.07137 -135.32016 7.75121 2.75810 -134.72885 1004.02570
1100.0000 -141.50378 -133.90008 7.60371 2.74963 -134.85861 1002.92055
1105.0000 -141.17392 -132.78620 8.38772 2.84420 -133.40931 1058.23929
1110.0000 -144.24754 -135.95695 8.29059 2.78867 -134.26030 1033.14031
1115.0000 -143.98031 -135.77092 8.20939 2.63932 -136.54929 923.59886
1120.0000 -143.56250 -135.16551 8.39699 2.70535 -135.53729 956.96881
1125.0000 -142.94823 -136.44337 6.50486 2.70543 -135.53606 972.87035
1130.0000 -143.28235 -135.65106 7.63129 2.64552 -136.45425 932.12083
1135.0000 -143.15978 -136.26518 6.89460 2.69495 -135.69669 950.81252
1140.0000 -144.87384 -138.41522 6.45862 2.58881 -137.32348 902.32734
1145.0000 -143.80324 -136.61313 7.19011 2.55200 -137.88753 861.51663
1150.0000 -142.80073 -135.93728 6.86345 2.62215 -136.81245 924.08299
1155.0000 -142.72268 -133.53808 9.18460 2.71582 -135.37682 990.04791
1160.0000 -143.62333 -135.31895 8.30437 2.70689 -135.51365 972.72257
1165.0000 -144.38845 -135.71882 8.66964 2.67054 -136.07085 949.05836
1170.0000 -140.28566 -133.81995 6.46571 2.75719 -134.74282 1027.26682
1175.0000 -142.44049 -134.39676 8.04372 2.76200 -134.66910 980.80681
1180.0000 -144.18758 -134.33677 9.85080 2.75073 -134.84172 996.26661
1185.0000 -141.05061 -133.26943 7.78118 2.81484 -133.85920 1042.22016
1190.0000 -140.68155 -134.33097 6.35058 2.86495 -133.09126 1076.69762
1195.0000 -142.50421 -134.98607 7.51815 2.76914 -134.55964 999.75105
1200.0000 -143.53010 -136.66560 6.86450 2.74585 -134.91653 975.83842
1205.0000 -144.29364 -136.58465 7.70899 2.66270 -136.19090 946.03495
1210.0000 -144.17716 -138.08161 6.09555 2.56248 -137.72689 861.25582
1215.0000 -143.03665 -136.02362 7.01304 2.60324 -137.10218 921.40541
1220.0000 -142.61508 -135.35335 7.26173 2.69683 -135.66782 967.42276
1225.0000 -142.63830 -136.05138 6.58693 2.71303 -135.41955 974.26580
1230.0000 -143.10916 -135.07343 8.03572 2.68573 -135.83802 915.46375
1235.0000 -141.40011 -133.92295 7.47716 2.74727 -134.89477 979.05243
1240.0000 -143.61753 -136.03974 7.57778 2.74950 -134.86070 1012.16978
1245.0000 -143.49026 -136.47660 7.01365 2.73739 -135.04625 984.12098
1250.0000 -142.31602 -135.81037 6.50564 2.65975 -136.23624 955.83840
FREEZING PROCESS: loop number 6 T-loop= 931.00000000000000
main_MD> interactions number 6 at Temperature= 931.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.03173 -0.06327 -4.16945
force_rgl> df(natom) -0.22713 -2.29994 -3.71072
1255.0000 -143.20944 -134.36758 8.84186 2.66314 -136.18420 927.07911
1260.0000 -143.02437 -135.35571 7.66865 2.74044 -134.99953 1013.66361
1265.0000 -143.63220 -136.61627 7.01593 2.60871 -137.01837 890.41092
1270.0000 -143.90460 -137.42386 6.48073 2.61266 -136.95782 904.65043
1275.0000 -142.59553 -135.76775 6.82777 2.63131 -136.67201 905.17379
1280.0000 -144.13441 -136.92622 7.20820 2.62864 -136.71303 916.05167
1285.0000 -143.33749 -136.01098 7.32650 2.73290 -135.11502 981.31246
1290.0000 -144.42798 -137.75928 6.66871 2.62560 -136.75959 921.88433
1295.0000 -142.41885 -136.15098 6.26787 2.60249 -137.11372 891.04040
1300.0000 -144.78826 -138.76520 6.02306 2.52048 -138.37068 822.52058
1305.0000 -144.71469 -138.32112 6.39356 2.52956 -138.23156 841.01233
1310.0000 -144.33224 -138.25787 6.07437 2.51289 -138.48704 845.53095
1315.0000 -143.71518 -136.54850 7.16667 2.57337 -137.56010 865.91506
1320.0000 -143.43661 -136.66696 6.76965 2.57069 -137.60112 867.20652
1325.0000 -144.83334 -137.31751 7.51584 2.62768 -136.72772 941.01347
1330.0000 -142.12619 -134.76744 7.35875 2.70454 -135.54976 974.81479
1335.0000 -142.28380 -134.82776 7.45604 2.70855 -135.48820 950.59635
1340.0000 -144.10546 -137.13771 6.96775 2.70313 -135.57125 968.04775
1345.0000 -145.13206 -138.53920 6.59286 2.55036 -137.91271 870.78529
1350.0000 -144.53265 -137.56734 6.96530 2.57106 -137.59544 892.64730
1355.0000 -145.09819 -139.58440 5.51379 2.52028 -138.37368 843.16435
1360.0000 -144.49375 -137.33054 7.16321 2.49227 -138.80306 828.91168
1365.0000 -145.54420 -138.39107 7.15313 2.53314 -138.17656 848.69496
1370.0000 -144.63372 -137.99337 6.64034 2.56180 -137.73737 871.15954
1375.0000 -145.40126 -137.52543 7.87582 2.52180 -138.35037 864.03364
1380.0000 -143.76751 -137.27850 6.48901 2.52809 -138.25405 848.95524
1385.0000 -143.33045 -136.76715 6.56330 2.59618 -137.21045 908.16413
1390.0000 -143.86216 -135.38114 8.48102 2.69919 -135.63170 956.08185
1395.0000 -144.20157 -137.80176 6.39981 2.63750 -136.57721 924.85120
1400.0000 -144.04366 -137.83438 6.20929 2.53297 -138.17918 839.09659
1405.0000 -143.71374 -136.13118 7.58256 2.58826 -137.33178 862.65262
1410.0000 -144.63868 -137.02609 7.61259 2.66818 -136.10697 967.51193
1415.0000 -143.84520 -135.36067 8.48454 2.63918 -136.55147 934.50321
1420.0000 -143.17924 -135.31662 7.86262 2.74161 -134.98159 985.81545
1425.0000 -142.15634 -134.51446 7.64187 2.73400 -135.09816 972.60274
1430.0000 -142.51782 -133.80761 8.71021 2.80912 -133.94684 1049.59472
1435.0000 -142.42861 -133.41614 9.01247 2.77330 -134.49587 1052.23384
1440.0000 -141.86863 -134.64424 7.22439 2.76335 -134.64841 995.59855
1445.0000 -141.35399 -133.97981 7.37418 2.77859 -134.41476 1010.15259
1450.0000 -143.61570 -137.35155 6.26415 2.70573 -135.53149 977.08290
1455.0000 -141.81796 -135.46370 6.35426 2.65936 -136.24219 950.76110
1460.0000 -142.93021 -136.37094 6.55927 2.63480 -136.61860 899.49611
1465.0000 -144.15150 -138.31988 5.83162 2.61485 -136.92435 898.86912
1470.0000 -144.74768 -136.79797 7.94971 2.59037 -137.29944 898.77503
1475.0000 -142.74729 -135.38509 7.36220 2.68479 -135.85239 971.79257
1480.0000 -143.34002 -135.85290 7.48712 2.69796 -135.65057 973.60550
1485.0000 -144.46434 -136.64120 7.82314 2.65712 -136.27654 931.63797
1490.0000 -143.31682 -137.57187 5.74495 2.64646 -136.43991 922.84597
1495.0000 -143.62625 -136.79905 6.82720 2.58854 -137.32761 883.86310
1500.0000 -143.95777 -135.41043 8.54734 2.64457 -136.46885 923.92439
FREEZING PROCESS: loop number 7 T-loop= 906.00000000000000
main_MD> interactions number 7 at Temperature= 906.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.18318 1.07427 0.60974
force_rgl> df(natom) -2.83240 -1.03212 -2.76666
1505.0000 -143.61925 -134.95628 8.66297 2.73792 -135.03813 1036.54717
1510.0000 -143.03023 -135.17384 7.85639 2.71523 -135.38591 973.06431
1515.0000 -143.91458 -136.19338 7.72120 2.69811 -135.64819 981.25664
1520.0000 -144.58934 -137.75793 6.83142 2.62426 -136.78007 925.79268
1525.0000 -143.59742 -138.37954 5.21787 2.55130 -137.89824 832.56244
1530.0000 -143.08040 -136.75258 6.32781 2.65015 -136.38336 900.55562
1535.0000 -142.70349 -135.23919 7.46430 2.72091 -135.29886 983.28389
1540.0000 -145.00749 -137.75873 7.24875 2.64612 -136.44512 919.55839
1545.0000 -143.33459 -136.33204 7.00256 2.57786 -137.49116 881.55807
1550.0000 -143.83711 -137.09573 6.74138 2.66021 -136.22907 958.59664
1555.0000 -142.77915 -135.96553 6.81362 2.61007 -136.99762 927.33368
1560.0000 -144.05810 -136.28952 7.76858 2.62900 -136.70741 899.43070
1565.0000 -144.58262 -137.03884 7.54378 2.65101 -136.37014 935.44405
1570.0000 -143.52755 -135.69405 7.83350 2.61647 -136.89956 913.24318
1575.0000 -142.90651 -135.12423 7.78228 2.71364 -135.41029 940.61510
1580.0000 -141.59136 -135.85773 5.73362 2.72542 -135.22976 1009.36237
1585.0000 -143.91482 -137.23985 6.67497 2.64489 -136.46392 919.20921
1590.0000 -143.86136 -136.73711 7.12425 2.57194 -137.58202 874.77645
1595.0000 -143.82081 -135.55159 8.26922 2.62666 -136.74338 924.44451
1600.0000 -143.09769 -136.17852 6.91917 2.69987 -135.62122 963.90174
1605.0000 -144.50767 -136.47638 8.03129 2.64110 -136.52199 896.28078
1610.0000 -145.80394 -139.22468 6.57926 2.62239 -136.80880 939.51698
1615.0000 -144.48771 -138.28444 6.20328 2.49908 -138.69865 820.90227
1620.0000 -143.76667 -136.02641 7.74026 2.61019 -136.99574 907.38617
1625.0000 -145.69248 -138.60977 7.08271 2.59379 -137.24712 889.80817
1630.0000 -143.20490 -135.97565 7.22926 2.55957 -137.77160 864.75248
1635.0000 -142.90281 -135.43832 7.46448 2.72987 -135.16154 1002.62647
1640.0000 -142.57326 -135.34603 7.22724 2.67229 -136.04393 899.79060
1645.0000 -144.51242 -137.83530 6.67711 2.65825 -136.25922 929.07669
1650.0000 -144.85536 -137.47162 7.38373 2.58732 -137.34632 880.92525
1655.0000 -145.01612 -138.45970 6.55642 2.55831 -137.79086 880.12111
1660.0000 -142.89109 -136.73423 6.15686 2.57361 -137.55641 862.37798
1665.0000 -143.33885 -137.04418 6.29467 2.60647 -137.05274 869.07374
1670.0000 -144.62672 -138.70545 5.92126 2.56378 -137.70707 864.65898
1675.0000 -144.85008 -136.91767 7.93241 2.57884 -137.47622 877.17816
1680.0000 -142.63614 -136.07925 6.55689 2.64727 -136.42751 903.20026
1685.0000 -143.97901 -136.24621 7.73279 2.69030 -135.76790 949.60821
1690.0000 -144.34198 -136.65607 7.68592 2.63542 -136.60909 904.60745
1695.0000 -143.69050 -137.01526 6.67524 2.67156 -136.05510 951.63183
1700.0000 -142.19251 -135.75368 6.43884 2.64820 -136.41324 929.95555
1705.0000 -144.40099 -138.23338 6.16761 2.59106 -137.28895 879.76425
1710.0000 -145.63523 -138.03368 7.60154 2.50733 -138.57219 850.09161
1715.0000 -146.21113 -139.84145 6.36967 2.43503 -139.68024 769.99258
1720.0000 -145.05720 -138.40932 6.64788 2.46233 -139.26183 799.35281
1725.0000 -144.75182 -138.05242 6.69940 2.48097 -138.97613 799.46046
1730.0000 -142.90004 -137.17087 5.72917 2.53372 -138.16768 850.78762
1735.0000 -144.36408 -137.25692 7.10716 2.59490 -137.23008 914.47773
1740.0000 -144.85873 -138.53947 6.31926 2.54600 -137.97957 878.04337
1745.0000 -144.08447 -137.31892 6.76555 2.55390 -137.85837 883.64963
1750.0000 -142.99223 -136.62816 6.36407 2.57673 -137.50849 872.65386
FREEZING PROCESS: loop number 8 T-loop= 881.00000000000000
main_MD> interactions number 8 at Temperature= 881.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.26397 -0.52834 -4.28677
force_rgl> df(natom) 1.46037 3.80816 -1.34871
1755.0000 -145.00670 -138.57452 6.43218 2.57383 -137.55294 883.04600
1760.0000 -142.68091 -136.49942 6.18148 2.58757 -137.34245 889.97062
1765.0000 -144.60564 -138.88068 5.72497 2.54835 -137.94347 851.46147
1770.0000 -143.84774 -137.97556 5.87219 2.54114 -138.05399 877.77371
1775.0000 -143.72512 -137.28670 6.43842 2.58836 -137.33036 896.17930
1780.0000 -145.81936 -138.22105 7.59831 2.54294 -138.02647 863.13309
1785.0000 -146.48720 -140.81884 5.66836 2.42336 -139.85919 792.89425
1790.0000 -144.55390 -138.24955 6.30435 2.45671 -139.34803 799.18218
1795.0000 -144.97429 -139.17372 5.80057 2.53192 -138.19531 859.71026
1800.0000 -145.69726 -139.83846 5.85880 2.43968 -139.60900 796.86231
1805.0000 -145.64582 -140.24296 5.40286 2.39140 -140.34894 744.97626
1810.0000 -145.13719 -139.94310 5.19409 2.39494 -140.29473 762.34925
1815.0000 -144.62922 -137.21781 7.41141 2.58231 -137.42299 892.62409
1820.0000 -143.93470 -136.81261 7.12210 2.62158 -136.82123 920.83198
1825.0000 -144.96592 -138.42099 6.54493 2.56543 -137.68174 892.89703
1830.0000 -144.64747 -137.74203 6.90543 2.55286 -137.87435 887.00626
1835.0000 -145.44510 -140.20309 5.24201 2.49346 -138.78483 807.47982
1840.0000 -144.89483 -137.55896 7.33587 2.51251 -138.49278 833.76469
1845.0000 -143.37361 -136.50063 6.87298 2.59955 -137.15882 882.09748
1850.0000 -145.45663 -138.79705 6.65958 2.55034 -137.91299 852.77595
1855.0000 -144.29653 -137.39201 6.90452 2.53246 -138.18704 866.99715
1860.0000 -143.52898 -137.28902 6.23997 2.58346 -137.40540 896.43948
1865.0000 -143.97544 -137.94499 6.03045 2.56329 -137.71458 848.70433
1870.0000 -144.68643 -137.56914 7.11729 2.57162 -137.58681 900.66150
1875.0000 -144.00211 -136.92883 7.07328 2.64704 -136.43099 926.67045
1880.0000 -144.00416 -136.23608 7.76808 2.62939 -136.70147 933.64950
1885.0000 -144.27770 -136.77749 7.50021 2.59561 -137.21918 906.67408
1890.0000 -142.53893 -135.97928 6.55965 2.67797 -135.95700 954.67955
1895.0000 -144.56203 -136.82252 7.73951 2.66444 -136.16434 946.28751
1900.0000 -143.51573 -136.05369 7.46205 2.64905 -136.40009 961.43819
1905.0000 -144.35951 -136.87354 7.48597 2.66551 -136.14782 949.27240
1910.0000 -145.31824 -136.37592 8.94232 2.64696 -136.43219 936.85957
1915.0000 -144.27569 -136.82612 7.44957 2.64629 -136.44241 925.01850
1920.0000 -142.32050 -135.18390 7.13659 2.67122 -136.06036 935.10878
1925.0000 -143.23356 -135.69282 7.54073 2.67359 -136.02407 928.90394
1930.0000 -144.77345 -138.25647 6.51698 2.62074 -136.83406 926.43418
1935.0000 -144.23018 -136.60864 7.62153 2.59957 -137.15843 921.72077
1940.0000 -143.98389 -136.83032 7.15357 2.62145 -136.82324 916.22204
1945.0000 -143.85389 -137.62400 6.22989 2.60564 -137.06542 904.35208
1950.0000 -144.16898 -137.20548 6.96350 2.59074 -137.29382 923.44448
1955.0000 -143.51669 -136.19507 7.32162 2.59795 -137.18338 901.71768
1960.0000 -142.93017 -135.47821 7.45196 2.68044 -135.91905 962.63255
1965.0000 -144.83294 -138.60957 6.22336 2.58508 -137.38052 882.38753
1970.0000 -145.16192 -137.85754 7.30438 2.56542 -137.68183 871.38485
1975.0000 -143.14309 -135.72016 7.42294 2.60417 -137.08795 892.82778
1980.0000 -141.92879 -135.29575 6.63303 2.70850 -135.48897 944.12258
1985.0000 -142.59103 -135.58061 7.01042 2.70154 -135.59570 984.45623
1990.0000 -145.55475 -138.42529 7.12946 2.57837 -137.48340 874.06815
1995.0000 -143.86332 -136.81872 7.04460 2.55177 -137.89107 879.01157
2000.0000 -143.79714 -136.54525 7.25190 2.61898 -136.86096 913.52702
FREEZING PROCESS: loop number 9 T-loop= 856.00000000000000
main_MD> interactions number 9 at Temperature= 856.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.49208 -4.22832 -3.06893
force_rgl> df(natom) 2.14902 -1.16494 0.48213
2005.0000 -143.81113 -136.44551 7.36562 2.59496 -137.22910 907.50839
2010.0000 -142.97810 -136.09996 6.87814 2.61534 -136.91686 901.36355
2015.0000 -144.34059 -137.09688 7.24372 2.65823 -136.25950 942.50221
2020.0000 -145.35540 -138.63694 6.71846 2.58034 -137.45315 887.61421
2025.0000 -145.84024 -139.10178 6.73846 2.50573 -138.59666 834.79227
2030.0000 -144.94894 -138.40617 6.54277 2.49606 -138.74497 845.02412
2035.0000 -144.49312 -138.46724 6.02588 2.49452 -138.76857 811.66204
2040.0000 -144.56028 -138.56721 5.99307 2.52825 -138.25163 852.82423
2045.0000 -144.44395 -137.74512 6.69883 2.51356 -138.47675 836.20757
2050.0000 -144.94748 -138.45496 6.49252 2.50878 -138.54989 801.47575
2055.0000 -143.89814 -137.94773 5.95042 2.53606 -138.13184 862.05953
2060.0000 -144.49215 -137.16203 7.33012 2.56745 -137.65075 845.19861
2065.0000 -144.42791 -137.57187 6.85604 2.58241 -137.42144 879.14402
2070.0000 -144.25316 -137.86712 6.38605 2.56528 -137.68403 852.05747
2075.0000 -145.38665 -137.16445 8.22220 2.58664 -137.35666 916.87487
2080.0000 -144.22300 -137.01924 7.20376 2.61013 -136.99663 877.15921
2085.0000 -142.16408 -133.95388 8.21020 2.73247 -135.12167 981.20755
2090.0000 -142.96322 -135.10718 7.85604 2.76826 -134.57317 974.27310
2095.0000 -144.65063 -137.28864 7.36199 2.65212 -136.35315 917.70198
2100.0000 -143.23765 -137.19305 6.04459 2.59469 -137.23331 876.84596
2105.0000 -143.82338 -136.58967 7.23371 2.60912 -137.01215 893.09937
2110.0000 -143.99990 -135.64147 8.35843 2.62176 -136.81844 904.05155
2115.0000 -145.51956 -138.73793 6.78163 2.59407 -137.24273 905.89275
2120.0000 -144.39913 -138.71414 5.68499 2.46173 -139.27108 833.45864
2125.0000 -145.81300 -138.66016 7.15284 2.51040 -138.52512 844.23794
2130.0000 -143.95067 -137.75535 6.19531 2.45915 -139.31066 791.96333
2135.0000 -143.82517 -137.74316 6.08201 2.56955 -137.61860 850.03118
2140.0000 -144.19623 -137.29160 6.90463 2.62608 -136.75223 911.19196
2145.0000 -145.16944 -138.66793 6.50150 2.55567 -137.83131 880.25657
2150.0000 -145.55802 -138.28718 7.27084 2.54105 -138.05536 850.64958
2155.0000 -144.53600 -138.70077 5.83523 2.48956 -138.84454 804.69257
2160.0000 -143.11318 -135.83687 7.27631 2.57499 -137.53516 864.80226
2165.0000 -144.11479 -137.26707 6.84772 2.62957 -136.69878 916.29391
2170.0000 -145.04118 -138.17918 6.86200 2.59099 -137.29005 885.20193
2175.0000 -143.58102 -137.27969 6.30133 2.60237 -137.11566 899.31532
2180.0000 -144.92061 -138.03590 6.88471 2.60236 -137.11574 875.40031
2185.0000 -145.63700 -138.66095 6.97604 2.52190 -138.34881 838.71099
2190.0000 -144.59372 -137.61541 6.97830 2.50028 -138.68026 851.34563
2195.0000 -143.88206 -137.43578 6.44628 2.53863 -138.09252 842.81195
2200.0000 -144.81870 -137.59084 7.22786 2.62618 -136.75068 896.07881
2205.0000 -143.11567 -135.20550 7.91017 2.69128 -135.75289 977.44742
2210.0000 -145.61913 -139.27071 6.34842 2.58602 -137.36618 867.44585
2215.0000 -144.06933 -137.57168 6.49766 2.54983 -137.92082 888.68041
2220.0000 -144.03260 -137.13548 6.89712 2.57321 -137.56243 887.49658
2225.0000 -145.96005 -138.54065 7.41940 2.57082 -137.59905 848.59875
2230.0000 -146.71768 -139.82224 6.89543 2.49631 -138.74108 857.90695
2235.0000 -145.14957 -137.71966 7.42990 2.49829 -138.71069 842.60136
2240.0000 -146.17869 -139.24690 6.93179 2.52150 -138.35501 836.01637
2245.0000 -145.25527 -137.47152 7.78375 2.55040 -137.91213 877.71994
2250.0000 -144.77017 -138.48917 6.28100 2.54609 -137.97814 870.48738
FREEZING PROCESS: loop number 10 T-loop= 831.00000000000000
main_MD> interactions number 10 at Temperature= 831.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.06782 -0.98083 1.78292
force_rgl> df(natom) -1.23352 -0.41015 1.31179
2255.0000 -145.34151 -138.72614 6.61536 2.48945 -138.84617 815.88968
2260.0000 -144.69685 -137.93249 6.76436 2.54270 -138.03016 848.26408
2265.0000 -146.99854 -140.30758 6.69096 2.48583 -138.90166 829.92909
2270.0000 -145.48229 -138.40855 7.07374 2.49012 -138.83593 837.67478
2275.0000 -146.00036 -139.63649 6.36387 2.54752 -137.95620 896.76158
2280.0000 -144.94172 -138.87351 6.06821 2.48412 -138.92788 817.72464
2285.0000 -146.15093 -139.39245 6.75848 2.44965 -139.45623 777.37080
2290.0000 -146.22955 -139.43890 6.79065 2.49460 -138.76728 825.47836
2295.0000 -145.43447 -139.97635 5.45812 2.44245 -139.56656 811.61109
2300.0000 -144.86377 -138.74625 6.11752 2.46456 -139.22770 786.04732
2305.0000 -147.04591 -141.93959 5.10632 2.42553 -139.82587 771.59597
2310.0000 -146.18673 -140.36220 5.82453 2.35153 -140.96004 699.93679
2315.0000 -145.21526 -139.87577 5.33950 2.45243 -139.41366 790.24644
2320.0000 -144.69058 -139.03366 5.65692 2.44147 -139.58155 789.73022
2325.0000 -145.60304 -139.59899 6.00405 2.42365 -139.85468 811.31299
2330.0000 -147.03947 -139.60324 7.43623 2.47148 -139.12167 853.94458
2335.0000 -145.51467 -139.76135 5.75333 2.42218 -139.87722 782.22366
2340.0000 -144.63169 -137.74077 6.89092 2.48322 -138.94176 804.40662
2345.0000 -144.70534 -138.46789 6.23745 2.52740 -138.26459 858.10512
2350.0000 -146.36556 -140.53846 5.82710 2.47679 -139.04021 821.97308
2355.0000 -144.64984 -138.63064 6.01921 2.41948 -139.91866 767.89377
2360.0000 -146.00415 -138.35225 7.65190 2.50287 -138.64052 840.60558
2365.0000 -144.64311 -138.46086 6.18225 2.54557 -137.98606 833.80022
2370.0000 -145.31884 -138.53630 6.78254 2.51524 -138.45093 817.11513
2375.0000 -145.37604 -139.37072 6.00532 2.45928 -139.30860 788.71053
2380.0000 -145.69732 -139.29812 6.39920 2.44432 -139.53796 796.70775
2385.0000 -146.03551 -138.44066 7.59485 2.48598 -138.89945 814.83155
2390.0000 -144.61548 -137.74867 6.86681 2.52725 -138.26692 840.74024
2395.0000 -146.49232 -140.21795 6.27438 2.51448 -138.46263 837.46635
2400.0000 -146.70376 -140.11526 6.58851 2.41160 -140.03933 756.88427
2405.0000 -145.98892 -140.05358 5.93534 2.43325 -139.70753 789.02228
2410.0000 -145.72387 -139.75727 5.96660 2.48117 -138.97314 811.04084
2415.0000 -146.47990 -139.11074 7.36916 2.42949 -139.76513 810.73435
2420.0000 -144.17745 -137.89016 6.28729 2.50228 -138.64962 817.90684
2425.0000 -144.06021 -137.42757 6.63264 2.56351 -137.71114 871.02081
2430.0000 -145.62230 -138.16234 7.45996 2.57437 -137.54467 881.75189
2435.0000 -142.39761 -135.36012 7.03749 2.62130 -136.82540 926.51489
2440.0000 -143.77983 -137.17655 6.60328 2.60778 -137.03264 872.02855
2445.0000 -144.62582 -137.40599 7.21983 2.59941 -137.16088 894.64987
2450.0000 -145.41876 -138.95561 6.46315 2.53475 -138.15196 846.29623
2455.0000 -145.56259 -140.02138 5.54121 2.43908 -139.61819 800.24619
2460.0000 -144.90737 -138.30093 6.60645 2.43723 -139.64654 766.10674
2465.0000 -144.10730 -137.56372 6.54358 2.53939 -138.08080 831.09384
2470.0000 -143.86020 -136.92612 6.93407 2.54027 -138.06733 840.33441
2475.0000 -142.54658 -134.82747 7.71911 2.63912 -136.55233 894.39543
2480.0000 -143.81590 -137.68276 6.13314 2.62504 -136.76817 904.94300
2485.0000 -143.28878 -136.04936 7.23942 2.63067 -136.68190 910.21180
2490.0000 -144.23254 -138.36224 5.87030 2.60031 -137.14722 901.49221
2495.0000 -146.19163 -138.36559 7.82604 2.49250 -138.79949 838.26688
2500.0000 -144.67069 -138.21939 6.45130 2.46951 -139.15187 831.45317
FREEZING PROCESS: loop number 11 T-loop= 806.00000000000000
main_MD> interactions number 11 at Temperature= 806.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.80165 2.23377 -0.74126
force_rgl> df(natom) -1.48266 -0.65414 -0.26328
2505.0000 -145.59359 -139.15788 6.43571 2.47372 -139.08734 809.12371
2510.0000 -145.09989 -139.05408 6.04582 2.45725 -139.33968 794.18004
2515.0000 -145.03300 -139.83942 5.19358 2.43857 -139.62606 785.75304
2520.0000 -144.79953 -138.70632 6.09321 2.44871 -139.47068 790.51897
2525.0000 -145.79546 -139.51934 6.27611 2.50577 -138.59602 808.09140
2530.0000 -144.86668 -139.49396 5.37272 2.41116 -140.04608 750.04793
2535.0000 -145.38400 -138.96019 6.42381 2.47674 -139.04094 810.19905
2540.0000 -146.86626 -139.77289 7.09337 2.40878 -140.08264 763.56857
2545.0000 -146.03229 -140.42243 5.60986 2.41616 -139.96948 797.24953
2550.0000 -144.57174 -138.68562 5.88612 2.46872 -139.16389 792.28341
2555.0000 -145.20136 -139.21028 5.99109 2.46302 -139.25123 814.26014
2560.0000 -145.40121 -139.54839 5.85283 2.46367 -139.24136 791.48097
2565.0000 -144.29369 -137.95361 6.34007 2.44949 -139.45866 802.70901
2570.0000 -145.13719 -139.42455 5.71264 2.51241 -138.49441 839.41543
2575.0000 -146.58901 -140.81170 5.77731 2.42644 -139.81186 805.28635
2580.0000 -145.64892 -139.52598 6.12293 2.38942 -140.37932 747.85697
2585.0000 -145.97137 -139.92777 6.04360 2.48820 -138.86537 838.94785
2590.0000 -146.62408 -141.17129 5.45279 2.33607 -141.19694 731.32683
2595.0000 -145.75964 -138.89902 6.86062 2.38809 -140.39972 769.00868
2600.0000 -143.20902 -137.84386 5.36515 2.51538 -138.44885 837.93000
2605.0000 -145.48131 -137.18842 8.29288 2.57449 -137.54286 867.53471
2610.0000 -145.41240 -139.20991 6.20249 2.49813 -138.71317 857.40737
2615.0000 -145.27708 -139.53035 5.74673 2.40514 -140.13837 782.80766
2620.0000 -146.65602 -139.85001 6.80601 2.39606 -140.27747 768.74873
2625.0000 -144.97680 -138.67663 6.30017 2.43837 -139.62905 806.21149
2630.0000 -144.56657 -138.13994 6.42663 2.47340 -139.09215 813.97760
2635.0000 -145.16747 -139.45334 5.71413 2.54096 -138.05675 875.44881
2640.0000 -145.36692 -139.60966 5.75726 2.48886 -138.85521 824.66861
2645.0000 -142.59266 -134.78778 7.80488 2.60216 -137.11874 892.15606
2650.0000 -143.83360 -137.65422 6.17938 2.67719 -135.96882 955.24486
2655.0000 -144.78478 -138.69840 6.08638 2.56676 -137.66136 878.52202
2660.0000 -145.98372 -140.06274 5.92098 2.45703 -139.34309 792.08336
2665.0000 -144.98804 -139.25723 5.73082 2.44424 -139.53916 789.08381
2670.0000 -145.58660 -139.82841 5.75819 2.45649 -139.35133 777.59510
2675.0000 -144.21114 -138.40384 5.80729 2.44275 -139.56198 777.61699
2680.0000 -145.62796 -138.89002 6.73794 2.47952 -138.99835 819.49989
2685.0000 -144.28603 -137.62777 6.65826 2.53583 -138.13534 873.67464
2690.0000 -145.22401 -138.27269 6.95132 2.55289 -137.87398 891.88558
2695.0000 -144.95928 -138.93313 6.02615 2.49921 -138.69663 826.19588
2700.0000 -144.68662 -139.12692 5.55970 2.47134 -139.12384 756.52226
2705.0000 -144.30873 -137.18317 7.12556 2.50990 -138.53284 808.02827
2710.0000 -146.16895 -139.27079 6.89816 2.48872 -138.85742 791.74025
2715.0000 -144.65684 -138.80548 5.85137 2.47791 -139.02303 807.98502
2720.0000 -146.67123 -141.07477 5.59647 2.38601 -140.43155 777.82889
2725.0000 -146.60890 -141.19301 5.41590 2.35300 -140.93741 733.91275
2730.0000 -146.54368 -140.32262 6.22105 2.35705 -140.87540 751.92478
2735.0000 -143.75364 -137.37806 6.37558 2.47806 -139.02081 844.20591
2740.0000 -143.87181 -137.01251 6.85930 2.57816 -137.48661 859.56395
2745.0000 -143.12867 -136.82289 6.30578 2.63403 -136.63032 927.85168
2750.0000 -145.45501 -138.63360 6.82141 2.51302 -138.48500 811.13702
FREEZING PROCESS: loop number 12 T-loop= 781.00000000000000
main_MD> interactions number 12 at Temperature= 781.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.87097 0.46567 -1.01648
force_rgl> df(natom) 1.67202 -0.54596 -0.77710
2755.0000 -143.76166 -137.14767 6.61399 2.55449 -137.84942 867.33203
2760.0000 -145.04987 -139.51773 5.53213 2.53183 -138.19665 808.13579
2765.0000 -147.31300 -140.47097 6.84203 2.44768 -139.48641 778.11726
2770.0000 -145.87156 -141.35022 4.52135 2.33674 -141.18675 720.76420
2775.0000 -146.26639 -140.21611 6.05028 2.35509 -140.90539 728.76470
2780.0000 -145.84290 -138.96235 6.88055 2.41878 -139.92933 800.68277
2785.0000 -145.99329 -139.46037 6.53292 2.49256 -138.79862 791.76412
2790.0000 -145.28915 -139.16654 6.12262 2.49563 -138.75157 795.99834
2795.0000 -145.65080 -138.54908 7.10172 2.49430 -138.77192 826.01537
2800.0000 -144.94724 -139.59826 5.34899 2.48243 -138.95377 818.98473
2805.0000 -145.63939 -139.92769 5.71170 2.44058 -139.59520 779.15037
2810.0000 -146.81357 -140.78718 6.02639 2.37907 -140.53797 756.56456
2815.0000 -145.93804 -139.48645 6.45159 2.43994 -139.60506 776.79416
2820.0000 -146.11493 -140.22230 5.89263 2.39650 -140.27079 774.53604
2825.0000 -145.83679 -140.03703 5.79976 2.40644 -140.11847 744.16068
2830.0000 -146.47512 -140.45164 6.02348 2.37139 -140.65556 753.84406
2835.0000 -146.48229 -139.93531 6.54698 2.37034 -140.67171 750.69640
2840.0000 -146.30505 -140.49167 5.81337 2.39831 -140.24301 755.05348
2845.0000 -146.16159 -139.97501 6.18658 2.43947 -139.61217 774.34298
2850.0000 -145.97248 -139.51841 6.45406 2.37924 -140.53534 706.78303
2855.0000 -145.82422 -140.32464 5.49958 2.43122 -139.73862 754.80401
2860.0000 -145.89278 -138.68495 7.20783 2.45061 -139.44142 791.97531
2865.0000 -145.45465 -139.00206 6.45259 2.49740 -138.72431 806.77403
2870.0000 -144.76202 -139.07516 5.68685 2.45010 -139.44934 734.76288
2875.0000 -144.62034 -138.05436 6.56598 2.52483 -138.30393 870.37785
2880.0000 -145.23953 -139.57024 5.66929 2.51004 -138.53061 840.07845
2885.0000 -144.85052 -139.39552 5.45500 2.45643 -139.35229 804.08889
2890.0000 -146.04391 -139.70318 6.34073 2.46669 -139.19502 799.28077
2895.0000 -145.21843 -139.72596 5.49248 2.44477 -139.53095 767.57902
2900.0000 -144.28059 -138.46110 5.81949 2.50576 -138.59618 774.57281
2905.0000 -145.92264 -139.35655 6.56609 2.47087 -139.13105 812.95674
2910.0000 -144.68739 -139.14314 5.54425 2.48930 -138.84854 807.07550
2915.0000 -145.07033 -137.38986 7.68046 2.51411 -138.46829 819.27669
2920.0000 -146.13981 -139.88942 6.25040 2.46600 -139.20557 835.10960
2925.0000 -147.55044 -142.41019 5.14026 2.34921 -140.99562 741.71976
2930.0000 -146.94515 -140.90442 6.04073 2.29123 -141.88422 676.59381
2935.0000 -147.43686 -140.70084 6.73602 2.35792 -140.86204 752.02884
2940.0000 -146.56325 -140.99219 5.57107 2.36912 -140.69040 738.49824
2945.0000 -145.26362 -139.63875 5.62487 2.43513 -139.67872 755.30770
2950.0000 -145.90548 -139.87373 6.03175 2.48106 -138.97480 823.99025
2955.0000 -146.60927 -139.86977 6.73950 2.44771 -139.48592 812.45313
2960.0000 -145.44693 -139.79235 5.65458 2.45492 -139.37544 807.59069
2965.0000 -146.55345 -140.98631 5.56714 2.39070 -140.35964 750.37562
2970.0000 -145.38741 -140.02466 5.36275 2.38994 -140.37136 714.00202
2975.0000 -146.58562 -140.14714 6.43848 2.43011 -139.75561 782.14497
2980.0000 -146.09781 -139.39330 6.70451 2.39848 -140.24050 784.59930
2985.0000 -146.01852 -139.51205 6.50647 2.40316 -140.16870 776.68672
2990.0000 -146.50852 -140.84825 5.66026 2.40731 -140.10505 778.82217
2995.0000 -145.57596 -140.98506 4.59090 2.34228 -141.10177 698.68865
3000.0000 -145.50290 -139.46330 6.03960 2.41676 -139.96030 780.44732
FREEZING PROCESS: loop number 13 T-loop= 756.00000000000000
main_MD> interactions number 13 at Temperature= 756.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.60630 5.17239 1.04192
force_rgl> df(natom) -0.50117 1.31097 1.57965
3005.0000 -146.65248 -141.46138 5.19110 2.36904 -140.69157 733.50154
3010.0000 -146.54883 -141.43643 5.11239 2.32066 -141.43309 728.40661
3015.0000 -145.81093 -138.67432 7.13661 2.43450 -139.68844 785.84698
3020.0000 -145.45841 -138.71506 6.74335 2.46821 -139.17176 827.67843
3025.0000 -145.41014 -139.90851 5.50163 2.43909 -139.61804 789.26442
3030.0000 -146.68346 -140.91833 5.76513 2.44510 -139.52600 777.05759
3035.0000 -146.95121 -140.44965 6.50156 2.40494 -140.14151 763.73174
3040.0000 -146.39873 -139.75317 6.64556 2.36934 -140.68706 728.71095
3045.0000 -146.74178 -139.94337 6.79842 2.40077 -140.20537 754.23147
3050.0000 -145.97718 -139.48652 6.49066 2.42305 -139.86390 791.44652
3055.0000 -146.56488 -141.53352 5.03136 2.41505 -139.98644 799.14065
3060.0000 -147.55245 -141.92704 5.62541 2.31257 -141.55716 694.88879
3065.0000 -146.58760 -141.36244 5.22516 2.30005 -141.74899 703.01818
3070.0000 -146.81690 -140.62132 6.19558 2.34432 -141.07057 718.70666
3075.0000 -146.61379 -141.73857 4.87522 2.35024 -140.97980 719.18135
3080.0000 -147.01865 -140.78647 6.23218 2.30431 -141.68378 701.76312
3085.0000 -146.54091 -141.44926 5.09164 2.36040 -140.82411 761.88918
3090.0000 -146.30010 -140.38604 5.91406 2.39385 -140.31138 753.56426
3095.0000 -146.40251 -141.29910 5.10341 2.33944 -141.14534 700.39024
3100.0000 -146.28899 -141.24500 5.04399 2.33321 -141.24085 699.48071
3105.0000 -146.16982 -141.24090 4.92891 2.33053 -141.28181 728.98188
3110.0000 -147.19024 -141.07261 6.11764 2.33474 -141.21736 737.51053
3115.0000 -146.13957 -141.01239 5.12718 2.34500 -141.06016 713.86285
3120.0000 -145.72349 -139.26905 6.45444 2.42968 -139.76223 754.78578
3125.0000 -145.07113 -140.07749 4.99364 2.43307 -139.71028 762.58455
3130.0000 -147.05408 -140.65846 6.39563 2.32760 -141.32684 699.78711
3135.0000 -146.06754 -139.71417 6.35337 2.39919 -140.22957 780.79842
3140.0000 -146.56885 -141.11883 5.45001 2.36426 -140.76492 762.96612
3145.0000 -146.64448 -141.27979 5.36470 2.35328 -140.93313 732.63507
3150.0000 -146.00092 -139.96176 6.03916 2.39292 -140.32559 744.03980
3155.0000 -146.97513 -141.04036 5.93477 2.36597 -140.73876 723.36224
3160.0000 -146.22316 -140.43416 5.78900 2.38467 -140.45213 736.02782
3165.0000 -144.90231 -139.15938 5.74292 2.44004 -139.60349 774.11217
3170.0000 -145.76152 -139.20061 6.56091 2.50010 -138.68306 819.19225
3175.0000 -146.04494 -140.03187 6.01307 2.40612 -140.12337 758.16684
3180.0000 -147.65107 -140.92939 6.72168 2.35852 -140.85289 715.15846
3185.0000 -145.83579 -140.96990 4.86589 2.31264 -141.55602 693.47861
3190.0000 -146.61295 -139.32999 7.28297 2.41379 -140.00578 803.07271
3195.0000 -146.48065 -140.36176 6.11889 2.41424 -139.99884 773.22889
3200.0000 -145.53799 -140.49224 5.04575 2.35186 -140.95491 753.52303
3205.0000 -145.12076 -138.16694 6.95382 2.43820 -139.63167 779.18808
3210.0000 -143.90216 -137.82591 6.07624 2.52409 -138.31526 866.58107
3215.0000 -145.53452 -138.90641 6.62811 2.56178 -137.73764 845.30858
3220.0000 -146.21929 -139.60251 6.61678 2.46949 -139.15208 817.99183
3225.0000 -146.05038 -139.43643 6.61395 2.42605 -139.81791 776.69962
3230.0000 -146.50166 -139.83721 6.66445 2.44326 -139.55410 786.11872
3235.0000 -145.15155 -140.06884 5.08271 2.45135 -139.43016 794.16319
3240.0000 -144.64435 -138.67584 5.96852 2.43228 -139.72246 752.47711
3245.0000 -146.74850 -140.74223 6.00627 2.43170 -139.73126 811.82429
3250.0000 -146.83743 -141.66048 5.17695 2.37586 -140.58714 738.70268
FREEZING PROCESS: loop number 14 T-loop= 731.00000000000000
main_MD> interactions number 14 at Temperature= 731.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.47521 0.55266 -1.98508
force_rgl> df(natom) -2.12608 -0.38457 -0.61599
3255.0000 -146.49009 -141.29754 5.19255 2.30933 -141.60670 664.50831
3260.0000 -145.61624 -138.98843 6.62781 2.46462 -139.22679 778.26016
3265.0000 -146.67751 -140.64075 6.03676 2.43414 -139.69393 799.60057
3270.0000 -146.20654 -140.15080 6.05574 2.36983 -140.67954 722.37770
3275.0000 -146.53224 -140.79441 5.73783 2.39340 -140.31837 762.85959
3280.0000 -146.56004 -140.13263 6.42741 2.38121 -140.50518 747.10679
3285.0000 -145.82439 -140.57546 5.24892 2.39862 -140.23826 765.71119
3290.0000 -145.10007 -140.13103 4.96904 2.38628 -140.42743 762.15966
3295.0000 -145.60810 -139.75234 5.85577 2.40971 -140.06837 796.02279
3300.0000 -145.95760 -140.73313 5.22447 2.39554 -140.28553 768.48674
3305.0000 -148.13830 -143.07096 5.06734 2.31581 -141.50751 709.75485
3310.0000 -147.42590 -141.80964 5.61625 2.28063 -142.04661 684.30074
3315.0000 -146.37315 -141.14927 5.22388 2.27355 -142.15513 685.15669
3320.0000 -146.53407 -141.15061 5.38346 2.35194 -140.95368 703.95758
3325.0000 -146.71065 -142.02391 4.68675 2.30937 -141.60622 669.73148
3330.0000 -145.83349 -140.63611 5.19738 2.35571 -140.89595 713.14418
3335.0000 -146.43159 -140.64349 5.78809 2.41296 -140.01854 746.03421
3340.0000 -147.64591 -142.31526 5.33065 2.30188 -141.72090 689.72419
3345.0000 -147.12568 -141.58568 5.54000 2.29162 -141.87824 687.81183
3350.0000 -146.69544 -141.33650 5.35894 2.29547 -141.81923 688.84334
3355.0000 -145.91381 -139.87213 6.04168 2.36782 -140.71037 740.22903
3360.0000 -146.44071 -141.27650 5.16421 2.38625 -140.42787 752.04623
3365.0000 -146.19971 -140.11507 6.08464 2.39133 -140.35006 755.17951
3370.0000 -145.34630 -139.36463 5.98167 2.39883 -140.23511 763.74356
3375.0000 -146.13453 -140.87588 5.25865 2.42342 -139.85824 749.74859
3380.0000 -145.84982 -141.25155 4.59826 2.33479 -141.21652 711.31362
3385.0000 -147.58040 -141.77100 5.80940 2.34028 -141.13246 754.90727
3390.0000 -147.16290 -142.09962 5.06328 2.29229 -141.86789 703.62540
3395.0000 -146.81489 -140.96974 5.84516 2.29108 -141.88642 696.85160
3400.0000 -147.62791 -140.97906 6.64884 2.32804 -141.32004 725.87843
3405.0000 -145.06985 -139.76401 5.30584 2.39224 -140.33609 776.02036
3410.0000 -146.75243 -140.91846 5.83397 2.34983 -140.98600 683.47289
3415.0000 -145.84358 -139.08915 6.75443 2.40118 -140.19908 745.77215
3420.0000 -146.72131 -140.79570 5.92561 2.39769 -140.25260 750.44603
3425.0000 -147.20891 -141.53934 5.66957 2.31625 -141.50064 711.40419
3430.0000 -147.15315 -140.87059 6.28256 2.32746 -141.32893 720.79253
3435.0000 -145.71455 -140.59369 5.12086 2.37807 -140.55320 751.76526
3440.0000 -146.75361 -141.17242 5.58119 2.28668 -141.95394 679.54744
3445.0000 -147.68790 -142.36722 5.32068 2.31469 -141.52464 741.73769
3450.0000 -148.20375 -143.30650 4.89725 2.27803 -142.08641 694.88056
3455.0000 -146.94848 -141.04172 5.90676 2.28191 -142.02709 688.77423
3460.0000 -147.47279 -142.11581 5.35698 2.32556 -141.35809 722.42402
3465.0000 -147.52788 -142.48665 5.04123 2.29434 -141.83657 708.68661
3470.0000 -147.21021 -140.80164 6.40857 2.31039 -141.59059 716.48121
3475.0000 -146.91606 -140.80857 6.10750 2.36658 -140.72931 751.45642
3480.0000 -148.02859 -142.77739 5.25120 2.29559 -141.81738 728.79064
3485.0000 -146.71724 -141.66666 5.05058 2.25644 -142.41733 687.06758
3490.0000 -147.16226 -141.63114 5.53112 2.28059 -142.04729 703.97177
3495.0000 -145.84732 -140.21817 5.62915 2.32441 -141.37561 690.54454
3500.0000 -146.34965 -141.37709 4.97256 2.37021 -140.67370 746.70266
FREEZING PROCESS: loop number 15 T-loop= 706.00000000000000
main_MD> interactions number 15 at Temperature= 706.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.30262 -1.20572 1.34407
force_rgl> df(natom) 1.02677 -0.47609 -2.77737
3505.0000 -147.81348 -141.88905 5.92443 2.27212 -142.17704 643.41166
3510.0000 -147.31521 -142.61294 4.70228 2.26458 -142.29261 662.11674
3515.0000 -146.61313 -141.02347 5.58966 2.31181 -141.56874 698.24250
3520.0000 -147.02881 -141.74505 5.28376 2.33596 -141.19860 720.21265
3525.0000 -145.92393 -140.06587 5.85805 2.36013 -140.82814 727.06927
3530.0000 -145.74203 -140.17740 5.56463 2.38986 -140.37259 738.23114
3535.0000 -146.55772 -140.51311 6.04461 2.36665 -140.72824 761.10863
3540.0000 -147.18865 -141.46186 5.72679 2.29496 -141.82706 670.93850
3545.0000 -146.20657 -141.28694 4.91963 2.33069 -141.27938 694.41117
3550.0000 -146.56756 -141.73263 4.83493 2.31299 -141.55067 707.96796
3555.0000 -147.91650 -142.29874 5.61776 2.28896 -141.91899 706.03172
3560.0000 -147.29108 -142.98659 4.30449 2.30283 -141.70638 736.92406
3565.0000 -147.43226 -143.08613 4.34614 2.21979 -142.97903 635.76467
3570.0000 -146.57042 -141.28737 5.28305 2.27620 -142.11449 678.36327
3575.0000 -147.91001 -142.35332 5.55668 2.30779 -141.63032 719.07794
3580.0000 -147.59468 -142.06513 5.52955 2.28816 -141.93121 682.37259
3585.0000 -146.35960 -141.17886 5.18074 2.31554 -141.51159 690.12202
3590.0000 -146.49262 -140.89917 5.59345 2.37048 -140.66957 742.73444
3595.0000 -147.19117 -142.42415 4.76702 2.34039 -141.13070 714.10280
3600.0000 -146.88330 -142.14030 4.74300 2.28268 -142.01520 685.97932
3605.0000 -146.59667 -140.60203 5.99464 2.30141 -141.72817 689.33003
3610.0000 -147.24683 -141.90461 5.34222 2.36205 -140.79880 746.55922
3615.0000 -147.14867 -141.38323 5.76545 2.25748 -142.40144 666.76527
3620.0000 -146.58505 -140.91321 5.67184 2.32592 -141.35257 719.80089
3625.0000 -147.36853 -142.72906 4.63946 2.29975 -141.75367 682.58235
3630.0000 -146.21572 -140.69765 5.51807 2.32743 -141.32936 701.79562
3635.0000 -145.62436 -139.60925 6.01510 2.37563 -140.59057 729.35685
3640.0000 -146.52213 -140.84495 5.67718 2.40056 -140.20853 748.92330
3645.0000 -146.15161 -140.27682 5.87479 2.33977 -141.14028 729.05322
3650.0000 -146.55519 -140.22368 6.33150 2.39283 -140.32705 754.51358
3655.0000 -145.43235 -140.53393 4.89842 2.39153 -140.34695 743.93327
3660.0000 -146.66737 -140.84694 5.82043 2.34111 -141.11976 732.05811
3665.0000 -146.82511 -142.12697 4.69814 2.34058 -141.12787 714.54653
3670.0000 -145.66766 -140.47317 5.19449 2.37670 -140.57432 735.18566
3675.0000 -146.40367 -140.58289 5.82078 2.38108 -140.50711 729.06988
3680.0000 -146.45813 -140.85430 5.60383 2.35646 -140.88450 713.87270
3685.0000 -147.52813 -142.64326 4.88487 2.30970 -141.60116 706.35711
3690.0000 -147.08621 -141.69996 5.38626 2.29639 -141.80508 681.26147
3695.0000 -146.98762 -141.68073 5.30689 2.29108 -141.88654 685.31228
3700.0000 -146.98945 -142.14232 4.84713 2.29472 -141.83076 664.71304
3705.0000 -146.10656 -140.91475 5.19182 2.28457 -141.98630 662.17553
3710.0000 -147.26041 -141.69244 5.56797 2.30957 -141.60306 677.30367
3715.0000 -147.35734 -141.55349 5.80385 2.30686 -141.64468 712.61890
3720.0000 -147.60331 -142.09038 5.51293 2.29974 -141.75371 684.85004
3725.0000 -148.66887 -142.73851 5.93036 2.21610 -143.03558 633.28081
3730.0000 -146.74364 -140.59288 6.15076 2.32813 -141.31869 706.22115
3735.0000 -146.36063 -141.11357 5.24705 2.35723 -140.87263 718.66679
3740.0000 -145.47225 -139.97426 5.49799 2.36461 -140.75953 733.82547
3745.0000 -147.24799 -140.25612 6.99186 2.41884 -139.92844 751.80850
3750.0000 -147.33870 -141.11386 6.22484 2.35652 -140.88360 787.14612
FREEZING PROCESS: loop number 16 T-loop= 681.00000000000000
main_MD> interactions number 16 at Temperature= 681.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.94116 1.27989 -0.03482
force_rgl> df(natom) -1.60401 -0.69019 1.69758
3755.0000 -147.86015 -142.26999 5.59016 2.31365 -141.54053 722.75943
3760.0000 -148.77547 -144.20205 4.57342 2.17836 -143.61411 630.88990
3765.0000 -149.60312 -143.72938 5.87374 2.20896 -143.14512 672.34727
3770.0000 -149.25931 -144.05354 5.20576 2.15488 -143.97386 630.91244
3775.0000 -146.66952 -141.50681 5.16272 2.27421 -142.14501 674.51944
3780.0000 -146.91787 -140.36768 6.55019 2.37833 -140.54920 735.49510
3785.0000 -147.82380 -143.51108 4.31272 2.28610 -141.96276 677.52690
3790.0000 -147.28214 -141.06479 6.21735 2.24365 -142.61341 645.55237
3795.0000 -147.37521 -141.84422 5.53099 2.28242 -142.01913 693.11553
3800.0000 -148.18602 -142.90804 5.27798 2.23082 -142.81010 645.26254
3805.0000 -147.40355 -142.73672 4.66683 2.21607 -143.03603 628.83871
3810.0000 -148.00664 -143.34644 4.66020 2.23000 -142.82265 656.66198
3815.0000 -146.88321 -140.44893 6.43429 2.30312 -141.70195 706.61589
3820.0000 -145.21471 -139.92736 5.28735 2.38810 -140.39951 750.57289
3825.0000 -147.19758 -140.61891 6.57867 2.38816 -140.39858 776.24642
3830.0000 -147.41488 -142.34519 5.06969 2.31002 -141.59623 710.13717
3835.0000 -145.74633 -140.14351 5.60282 2.30989 -141.59818 709.43590
3840.0000 -145.47596 -140.63342 4.84254 2.36590 -140.73972 747.35708
3845.0000 -147.05919 -142.03366 5.02552 2.32136 -141.42241 713.03032
3850.0000 -148.19405 -142.87654 5.31751 2.24841 -142.54051 667.48609
3855.0000 -146.88827 -142.17294 4.71534 2.25424 -142.45108 687.06142
3860.0000 -148.21783 -143.58150 4.63633 2.28383 -141.99763 677.67737
3865.0000 -146.67778 -142.05032 4.62746 2.21659 -143.02806 636.29880
3870.0000 -146.59218 -141.25050 5.34168 2.29817 -141.77782 659.21068
3875.0000 -146.86145 -141.44880 5.41264 2.33331 -141.23929 715.59394
3880.0000 -147.82650 -143.13731 4.68918 2.24709 -142.56062 628.45783
3885.0000 -147.81157 -142.88533 4.92624 2.23459 -142.75225 633.18994
3890.0000 -147.92458 -142.83824 5.08634 2.23076 -142.81099 643.98299
3895.0000 -146.33182 -141.63972 4.69210 2.28293 -142.01144 669.24779
3900.0000 -146.38240 -140.61287 5.76953 2.30781 -141.63010 663.61164
3905.0000 -146.35054 -140.47492 5.87562 2.38920 -140.38262 745.67504
3910.0000 -147.85616 -142.11455 5.74161 2.31818 -141.47116 683.87999
3915.0000 -146.77762 -142.06090 4.71672 2.26768 -142.24517 680.59695
3920.0000 -147.78073 -142.15824 5.62249 2.28224 -142.02199 668.02397
3925.0000 -147.21734 -142.41155 4.80579 2.25229 -142.48101 646.25708
3930.0000 -146.83341 -142.25997 4.57345 2.25841 -142.38714 651.72087
3935.0000 -147.63460 -142.06238 5.57222 2.24489 -142.59436 633.61568
3940.0000 -148.00776 -143.30405 4.70371 2.24398 -142.60836 649.14841
3945.0000 -148.35502 -142.47299 5.88204 2.25660 -142.41494 654.55072
3950.0000 -147.52969 -142.00411 5.52558 2.18927 -143.44689 630.51054
3955.0000 -146.70989 -141.80895 4.90094 2.29033 -141.89797 704.18143
3960.0000 -148.63748 -143.15052 5.48696 2.26019 -142.35990 684.80357
3965.0000 -146.59913 -142.27244 4.32670 2.24640 -142.57124 656.40852
3970.0000 -147.25940 -142.29006 4.96934 2.24117 -142.65142 635.55529
3975.0000 -145.07913 -140.69301 4.38612 2.31922 -141.45521 669.75981
3980.0000 -147.31158 -141.92982 5.38176 2.33887 -141.15398 681.49010
3985.0000 -147.82204 -142.04450 5.77754 2.30857 -141.61846 704.84043
3990.0000 -147.83762 -142.73165 5.10598 2.28422 -141.99156 686.82415
3995.0000 -147.54203 -142.51671 5.02532 2.26919 -142.22194 679.05668
4000.0000 -146.63213 -141.10937 5.52276 2.29657 -141.80236 697.95385
FREEZING PROCESS: loop number 17 T-loop= 656.00000000000000
main_MD> interactions number 17 at Temperature= 656.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.34180 -1.07943 -0.63762
force_rgl> df(natom) 7.04531 2.04152 1.74746
4005.0000 -148.55949 -143.78947 4.77002 2.28237 -142.01994 681.53909
4010.0000 -147.46874 -142.76151 4.70723 2.18959 -143.44188 606.20068
4015.0000 -147.84781 -142.68626 5.16155 2.20700 -143.17516 627.77062
4020.0000 -147.94869 -143.12355 4.82514 2.23428 -142.75703 633.36486
4025.0000 -147.74412 -142.39194 5.35218 2.23009 -142.82118 653.34955
4030.0000 -147.49481 -142.59327 4.90154 2.26918 -142.22217 654.09404
4035.0000 -148.22093 -143.79909 4.42184 2.20940 -143.13835 612.57387
4040.0000 -147.92778 -143.35672 4.57106 2.17884 -143.60672 624.58509
4045.0000 -147.90266 -142.78853 5.11413 2.16816 -143.77036 611.91299
4050.0000 -147.88587 -142.27628 5.60959 2.24631 -142.57264 647.93784
4055.0000 -148.14752 -143.42978 4.71774 2.22142 -142.95403 630.23266
4060.0000 -147.76856 -142.45844 5.31012 2.20162 -143.25751 604.83436
4065.0000 -147.80853 -143.36771 4.44082 2.22588 -142.88575 636.79175
4070.0000 -147.78988 -142.47790 5.31197 2.22012 -142.97400 644.24714
4075.0000 -147.07985 -142.47743 4.60242 2.27639 -142.11163 662.82812
4080.0000 -146.74325 -141.29110 5.45215 2.27815 -142.08460 667.27491
4085.0000 -148.24975 -142.25631 5.99344 2.30131 -141.72974 692.01255
4090.0000 -146.65481 -141.96051 4.69430 2.24770 -142.55135 640.58800
4095.0000 -149.38264 -143.05772 6.32492 2.25170 -142.48995 634.80708
4100.0000 -148.31333 -143.09067 5.22266 2.19148 -143.41290 603.93137
4105.0000 -147.73128 -142.16212 5.56916 2.22949 -142.83043 639.65770
4110.0000 -146.40958 -140.81317 5.59641 2.32859 -141.31156 723.86606
4115.0000 -146.85941 -141.54402 5.31539 2.33441 -141.22236 703.82585
4120.0000 -147.61893 -143.01049 4.60844 2.24190 -142.64029 624.35779
4125.0000 -147.55705 -142.14106 5.41600 2.28354 -142.00205 671.30034
4130.0000 -147.55021 -141.89354 5.65666 2.25893 -142.37918 642.23843
4135.0000 -147.86326 -142.16325 5.70002 2.27615 -142.11523 664.73756
4140.0000 -149.10036 -143.20450 5.89585 2.23478 -142.74939 645.72265
4145.0000 -147.76500 -143.14970 4.61531 2.20323 -143.23286 627.58335
4150.0000 -148.47194 -143.82213 4.64982 2.16547 -143.81162 615.92142
4155.0000 -147.50552 -142.89109 4.61443 2.22750 -142.86091 643.27733
4160.0000 -148.67042 -144.38347 4.28695 2.19342 -143.38327 628.42642
4165.0000 -147.41846 -142.72004 4.69842 2.21955 -142.98273 648.23255
4170.0000 -146.62601 -141.51053 5.11548 2.25078 -142.50417 662.64530
4175.0000 -146.30113 -141.44083 4.86030 2.30263 -141.70939 683.54409
4180.0000 -145.93749 -140.71845 5.21903 2.30949 -141.60433 680.06292
4185.0000 -147.17970 -142.36114 4.81856 2.29865 -141.77049 684.90451
4190.0000 -147.08003 -141.68492 5.39511 2.31384 -141.53771 699.17318
4195.0000 -147.18110 -141.24991 5.93119 2.34228 -141.10183 724.19046
4200.0000 -146.93874 -142.15488 4.78386 2.33622 -141.19464 716.49274
4205.0000 -147.76218 -142.32869 5.43349 2.27616 -142.11507 643.99664
4210.0000 -147.94036 -143.16246 4.77790 2.23770 -142.70466 641.19417
4215.0000 -146.54076 -140.61889 5.92188 2.35394 -140.92307 725.78686
4220.0000 -148.20029 -142.63271 5.56758 2.27828 -142.08264 692.38231
4225.0000 -147.79392 -142.89242 4.90150 2.23342 -142.77022 649.70668
4230.0000 -146.43384 -141.65983 4.77400 2.29344 -141.85024 707.35677
4235.0000 -148.76115 -143.13808 5.62307 2.26977 -142.21305 680.84838
4240.0000 -148.80173 -144.33836 4.46336 2.22021 -142.97264 646.37457
4245.0000 -147.38590 -143.27493 4.11097 2.17528 -143.66120 619.99606
4250.0000 -148.40702 -143.05003 5.35699 2.17067 -143.73192 589.51667
FREEZING PROCESS: loop number 18 T-loop= 631.00000000000000
main_MD> interactions number 18 at Temperature= 631.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.36665 9.37711 4.04081
force_rgl> df(natom) 2.14201 0.36571 -1.50707
4255.0000 -148.06148 -143.04675 5.01473 2.20406 -143.22016 642.44530
4260.0000 -147.55199 -141.81700 5.73499 2.24121 -142.65083 670.71105
4265.0000 -147.39503 -142.23228 5.16274 2.24272 -142.62766 674.40400
4270.0000 -147.46401 -142.28578 5.17822 2.26816 -142.23773 663.23324
4275.0000 -147.96202 -142.88790 5.07412 2.22013 -142.97388 647.40094
4280.0000 -148.39311 -142.19361 6.19950 2.25263 -142.47572 661.87689
4285.0000 -148.05996 -143.67815 4.38181 2.22147 -142.95338 657.01858
4290.0000 -146.68258 -141.83457 4.84802 2.21564 -143.04262 630.17234
4295.0000 -147.71745 -142.36509 5.35236 2.26481 -142.28909 644.02190
4300.0000 -147.81393 -143.07629 4.73764 2.22324 -142.92614 623.80816
4305.0000 -148.39776 -143.61532 4.78244 2.19746 -143.32130 619.19138
4310.0000 -148.48211 -143.13686 5.34525 2.23988 -142.67124 654.04117
4315.0000 -148.10439 -143.44267 4.66172 2.19105 -143.41950 626.88093
4320.0000 -148.53182 -143.41482 5.11700 2.16634 -143.79827 608.55232
4325.0000 -148.01154 -143.70606 4.30549 2.17794 -143.62053 635.26224
4330.0000 -148.09149 -143.64981 4.44168 2.17096 -143.72752 609.54990
4335.0000 -147.01561 -142.70533 4.31028 2.15572 -143.96106 576.72549
4340.0000 -147.74659 -142.97347 4.77312 2.23182 -142.79469 657.79404
4345.0000 -147.76064 -142.86186 4.89878 2.22292 -142.93117 671.70622
4350.0000 -147.70417 -142.87103 4.83314 2.23473 -142.75011 661.26547
4355.0000 -147.98400 -143.55486 4.42914 2.20515 -143.20344 629.99884
4360.0000 -148.06957 -143.30259 4.76697 2.21228 -143.09425 652.38278
4365.0000 -148.85917 -143.72503 5.13414 2.14921 -144.06083 590.28041
4370.0000 -147.35467 -142.68639 4.66828 2.16330 -143.84480 591.80108
4375.0000 -147.15709 -143.19302 3.96407 2.21171 -143.10286 618.31184
4380.0000 -147.56108 -142.48436 5.07672 2.23084 -142.80971 639.21753
4385.0000 -148.13782 -143.61490 4.52292 2.20548 -143.19847 618.75235
4390.0000 -147.40184 -143.01791 4.38393 2.22981 -142.82548 624.68069
4395.0000 -147.66059 -143.03080 4.62979 2.20701 -143.17493 609.15003
4400.0000 -147.87769 -143.20320 4.67449 2.22805 -142.85242 639.13430
4405.0000 -148.03655 -142.85368 5.18287 2.21123 -143.11028 632.07433
4410.0000 -147.93602 -143.41485 4.52117 2.16259 -143.85581 567.51800
4415.0000 -148.22296 -143.82150 4.40146 2.17593 -143.65132 595.10323
4420.0000 -148.28827 -143.85879 4.42947 2.12830 -144.38121 550.35415
4425.0000 -148.19014 -143.89373 4.29641 2.16605 -143.80269 595.61815
4430.0000 -147.95180 -143.35326 4.59854 2.22142 -142.95407 616.61857
4435.0000 -149.30632 -144.92389 4.38244 2.14580 -144.11306 575.20876
4440.0000 -148.30997 -143.71185 4.59812 2.15036 -144.04317 582.18343
4445.0000 -149.09335 -144.16409 4.92926 2.11565 -144.57519 570.43254
4450.0000 -148.28480 -144.04084 4.24396 2.14354 -144.14763 581.61231
4455.0000 -147.85911 -143.27446 4.58465 2.17787 -143.62151 606.07519
4460.0000 -148.76110 -144.06581 4.69529 2.21654 -143.02892 642.32863
4465.0000 -147.81176 -143.41421 4.39754 2.20748 -143.16772 629.68654
4470.0000 -147.64180 -142.21135 5.43045 2.22083 -142.96316 606.17146
4475.0000 -146.70866 -141.71475 4.99392 2.30332 -141.69895 665.93292
4480.0000 -147.70554 -141.65472 6.05082 2.27651 -142.10985 670.94983
4485.0000 -147.52189 -142.70542 4.81647 2.25991 -142.36419 657.41113
4490.0000 -147.15992 -141.40255 5.75737 2.29961 -141.75574 683.84022
4495.0000 -147.46928 -142.41786 5.05142 2.28148 -142.03364 680.57403
4500.0000 -147.61401 -142.19043 5.42358 2.23170 -142.79661 648.63524
FREEZING PROCESS: loop number 19 T-loop= 606.00000000000000
main_MD> interactions number 19 at Temperature= 606.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.97393 -1.85001 -1.27225
force_rgl> df(natom) 0.17331 -0.33299 -1.41198
4505.0000 -148.58376 -143.43815 5.14561 2.22258 -142.93633 648.89790
4510.0000 -149.10775 -145.03395 4.07380 2.12360 -144.45328 604.48421
4515.0000 -148.34650 -144.07060 4.27589 2.12049 -144.50098 576.96072
4520.0000 -148.78025 -143.64645 5.13380 2.18026 -143.58494 597.65605
4525.0000 -148.32577 -143.61666 4.70912 2.17412 -143.67895 594.05459
4530.0000 -148.61792 -143.47200 5.14592 2.19417 -143.37171 612.43086
4535.0000 -147.98540 -143.36783 4.61757 2.20098 -143.26739 618.31675
4540.0000 -148.12948 -143.68922 4.44025 2.16120 -143.87702 613.65981
4545.0000 -148.08728 -143.59573 4.49156 2.21286 -143.08522 660.12857
4550.0000 -149.57540 -144.70309 4.87231 2.14753 -144.08659 634.09146
4555.0000 -149.35457 -145.74888 3.60569 2.05367 -145.52500 568.50666
4560.0000 -148.71131 -144.57975 4.13156 2.08510 -145.04342 568.20545
4565.0000 -149.05492 -143.69256 5.36236 2.14301 -144.15581 597.28747
4570.0000 -148.67813 -143.84237 4.83576 2.14094 -144.18762 594.04235
4575.0000 -148.02701 -143.39421 4.63280 2.17786 -143.62174 597.30678
4580.0000 -148.89536 -143.98905 4.90631 2.18751 -143.47380 600.14931
4585.0000 -148.88593 -144.50746 4.37847 2.15542 -143.96569 592.41753
4590.0000 -149.37407 -144.13000 5.24407 2.11983 -144.51108 575.20246
4595.0000 -147.63870 -142.63864 5.00006 2.21246 -143.09140 631.91378
4600.0000 -148.32809 -143.53176 4.79633 2.18973 -143.43983 609.80738
4605.0000 -149.33388 -143.33207 6.00181 2.19563 -143.34935 642.38244
4610.0000 -147.71250 -143.55080 4.16170 2.19367 -143.37941 631.69796
4615.0000 -148.32587 -143.01487 5.31100 2.20420 -143.21802 619.99033
4620.0000 -147.35228 -141.86777 5.48452 2.24274 -142.62737 663.35973
4625.0000 -147.30824 -143.37096 3.93728 2.27599 -142.11772 656.56283
4630.0000 -149.14280 -144.08836 5.05444 2.17386 -143.68300 584.32530
4635.0000 -148.28987 -143.85669 4.43318 2.13239 -144.31864 557.31120
4640.0000 -148.95100 -143.33744 5.61356 2.19894 -143.29856 633.19833
4645.0000 -148.76390 -144.54028 4.22362 2.17442 -143.67445 622.75390
4650.0000 -150.11116 -144.67826 5.43290 2.10427 -144.74963 557.40330
4655.0000 -149.73193 -145.04538 4.68655 2.09967 -144.82012 564.12035
4660.0000 -150.42675 -145.07287 5.35388 2.08839 -144.99297 587.96420
4665.0000 -148.12664 -142.25586 5.87078 2.17433 -143.67583 655.81651
4670.0000 -148.17221 -143.55432 4.61789 2.25312 -142.46820 678.42943
4675.0000 -147.52882 -142.87156 4.65725 2.20222 -143.24832 608.45093
4680.0000 -147.91896 -142.44953 5.46942 2.21939 -142.98529 633.77317
4685.0000 -148.69004 -144.51193 4.17811 2.17211 -143.70988 613.72823
4690.0000 -147.53475 -142.82522 4.70953 2.19163 -143.41068 624.01323
4695.0000 -148.16627 -143.67086 4.49541 2.19054 -143.42736 599.55377
4700.0000 -148.21406 -142.80190 5.41216 2.19552 -143.35111 602.19605
4705.0000 -147.44201 -143.11467 4.32734 2.18297 -143.54343 608.19948
4710.0000 -148.63613 -143.45674 5.17938 2.18594 -143.49788 619.05240
4715.0000 -148.36329 -144.05080 4.31249 2.16987 -143.74417 615.50347
4720.0000 -149.05724 -145.03492 4.02232 2.09947 -144.82319 560.21250
4725.0000 -149.09837 -145.13033 3.96804 2.05878 -145.44669 537.03131
4730.0000 -149.02569 -144.38658 4.63911 2.10135 -144.79431 575.35663
4735.0000 -149.28891 -143.10952 6.17940 2.16076 -143.88380 620.70816
4740.0000 -148.42664 -144.02877 4.39787 2.13354 -144.30095 629.14390
4745.0000 -148.74698 -144.17536 4.57162 2.15552 -143.96410 630.97942
4750.0000 -149.62785 -144.59205 5.03580 2.10835 -144.68696 589.33755
FREEZING PROCESS: loop number 20 T-loop= 581.00000000000000
main_MD> interactions number 20 at Temperature= 581.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.27460 -1.43400 -0.77839
force_rgl> df(natom) -4.73366 -5.13203 4.10238
4755.0000 -149.15178 -144.29616 4.85563 2.11105 -144.64568 598.61390
4760.0000 -148.75405 -144.73176 4.02229 2.12597 -144.41693 599.60133
4765.0000 -148.10047 -144.24666 3.85381 2.09478 -144.89496 558.41528
4770.0000 -147.78457 -143.23599 4.54859 2.17288 -143.69808 586.24252
4775.0000 -148.15727 -143.19254 4.96473 2.19567 -143.34875 597.57558
4780.0000 -147.23681 -143.14064 4.09617 2.19493 -143.36012 609.24441
4785.0000 -149.58329 -144.24256 5.34073 2.15329 -143.99827 584.06920
4790.0000 -148.41642 -144.16508 4.25134 2.12640 -144.41034 574.19899
4795.0000 -147.45184 -142.94625 4.50559 2.17495 -143.66630 582.07221
4800.0000 -149.18103 -144.62895 4.55207 2.19135 -143.41492 621.13340
4805.0000 -148.25356 -144.51396 3.73960 2.13033 -144.35019 564.85648
4810.0000 -148.91990 -144.36718 4.55272 2.14350 -144.14838 586.62520
4815.0000 -148.64314 -144.32603 4.31711 2.12133 -144.48808 565.32076
4820.0000 -148.51851 -143.92820 4.59031 2.14323 -144.15252 571.31392
4825.0000 -148.35750 -144.45106 3.90644 2.12760 -144.39200 563.81042
4830.0000 -148.68177 -143.99764 4.68413 2.15109 -144.03201 568.95654
4835.0000 -148.33120 -143.51273 4.81847 2.18825 -143.46250 617.61782
4840.0000 -150.26818 -146.69043 3.57775 2.10286 -144.77124 571.02282
4845.0000 -148.94017 -144.59458 4.34558 2.04679 -145.63055 533.97900
4850.0000 -149.22266 -144.61252 4.61014 2.09934 -144.82512 592.08556
4855.0000 -148.38036 -143.95594 4.42442 2.13094 -144.34076 583.90609
4860.0000 -148.49863 -143.77230 4.72633 2.16752 -143.78014 577.11627
4865.0000 -148.67411 -143.35815 5.31596 2.13684 -144.25043 565.83898
4870.0000 -148.92448 -144.27750 4.64698 2.14211 -144.16956 567.53483
4875.0000 -148.86571 -143.72111 5.14460 2.12699 -144.40140 554.03318
4880.0000 -148.63957 -144.06855 4.57102 2.16875 -143.76126 623.24724
4885.0000 -148.34092 -143.43036 4.91056 2.18175 -143.56205 610.32985
4890.0000 -148.36185 -143.80825 4.55360 2.17449 -143.67329 598.83267
4895.0000 -148.44009 -144.05892 4.38117 2.16959 -143.74840 598.24460
4900.0000 -148.99612 -143.71606 5.28007 2.15307 -144.00158 594.49286
4905.0000 -148.81379 -144.15315 4.66064 2.18256 -143.54966 608.37934
4910.0000 -148.25116 -144.18214 4.06901 2.11734 -144.54929 569.06138
4915.0000 -148.35686 -143.59576 4.76110 2.19034 -143.43040 621.91161
4920.0000 -148.84238 -143.52593 5.31645 2.17745 -143.62793 619.03861
4925.0000 -148.68712 -144.41645 4.27067 2.14967 -144.05381 600.11485
4930.0000 -147.83078 -143.33583 4.49495 2.15323 -143.99919 562.58751
4935.0000 -148.41478 -144.07582 4.33896 2.17426 -143.67685 552.09577
4940.0000 -147.73483 -143.82922 3.90561 2.17541 -143.65923 597.04392
4945.0000 -149.23204 -145.36119 3.87085 2.11165 -144.63643 551.31977
4950.0000 -148.85604 -144.98922 3.86682 2.05867 -145.44841 497.95286
4955.0000 -148.41625 -144.24742 4.16883 2.12411 -144.44551 570.84253
4960.0000 -148.60097 -143.80813 4.79284 2.16967 -143.74725 595.19483
4965.0000 -149.43112 -144.83425 4.59686 2.14343 -144.14941 580.63769
4970.0000 -147.93355 -143.56097 4.37258 2.14973 -144.05278 579.96819
4975.0000 -148.54488 -144.63548 3.90940 2.13520 -144.27554 558.97396
4980.0000 -149.06886 -144.27609 4.79277 2.12425 -144.44342 556.78090
4985.0000 -148.83087 -144.73445 4.09642 2.13848 -144.22521 569.76303
4990.0000 -149.72336 -145.37476 4.34860 2.09256 -144.92908 553.66836
4995.0000 -149.39351 -145.04363 4.34988 2.06044 -145.42127 525.45317
5000.0000 -148.88044 -144.64262 4.23782 2.09901 -144.83020 551.56164
FREEZING PROCESS: loop number 21 T-loop= 556.00000000000000
main_MD> interactions number 21 at Temperature= 556.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.85805 0.29637 0.48369
force_rgl> df(natom) -1.78512 -1.02270 -1.41605
5005.0000 -149.12127 -145.40218 3.71909 2.10952 -144.66904 536.85484
5010.0000 -149.44440 -144.78291 4.66149 2.05169 -145.55539 505.79225
5015.0000 -148.60162 -143.86860 4.73303 2.10372 -144.75793 557.97623
5020.0000 -149.07431 -144.18422 4.89009 2.13386 -144.29610 593.61174
5025.0000 -148.72704 -144.79860 3.92844 2.11118 -144.64363 557.27270
5030.0000 -149.41376 -145.33294 4.08082 2.09377 -144.91041 585.32773
5035.0000 -149.11214 -145.40469 3.70745 2.03048 -145.88043 532.27721
5040.0000 -148.96083 -144.65818 4.30265 2.09414 -144.90487 564.41242
5045.0000 -148.29579 -143.21457 5.08122 2.16952 -143.74953 598.35311
5050.0000 -147.67534 -142.93183 4.74352 2.19819 -143.31013 600.49536
5055.0000 -147.59579 -142.85294 4.74286 2.21189 -143.10013 595.41883
5060.0000 -149.00262 -144.50278 4.49984 2.15714 -143.93923 573.61387
5065.0000 -148.82852 -144.57954 4.24898 2.13425 -144.29013 582.57025
5070.0000 -149.59380 -144.77405 4.81975 2.14366 -144.14593 602.51184
5075.0000 -149.97295 -145.58704 4.38591 2.11967 -144.51348 560.84144
5080.0000 -148.78035 -144.51904 4.26131 2.08787 -145.00087 527.61258
5085.0000 -148.62170 -144.56489 4.05681 2.10467 -144.74349 542.24913
5090.0000 -150.04594 -145.08919 4.95674 2.09801 -144.84545 560.81941
5095.0000 -149.15156 -143.98054 5.17102 2.13535 -144.27321 573.26898
5100.0000 -149.23820 -144.59451 4.64370 2.14258 -144.16242 600.19673
5105.0000 -149.24583 -145.14464 4.10119 2.10090 -144.80125 566.05503
5110.0000 -149.82618 -145.23893 4.58725 2.05593 -145.49047 553.60550
5115.0000 -150.09298 -146.14993 3.94305 2.03745 -145.77367 543.54716
5120.0000 -150.74233 -146.60299 4.13935 1.98406 -146.59187 506.22427
5125.0000 -150.88768 -146.57105 4.31663 2.00706 -146.23949 539.22939
5130.0000 -149.26960 -145.14650 4.12309 2.01158 -146.17007 544.69103
5135.0000 -150.08935 -144.99130 5.09805 2.08318 -145.07283 594.93411
5140.0000 -149.93512 -145.94142 3.99370 2.04763 -145.61758 583.42821
5145.0000 -149.77774 -145.50448 4.27327 2.04115 -145.71700 563.59022
5150.0000 -150.88930 -146.94281 3.94649 2.01021 -146.19110 560.10822
5155.0000 -150.39465 -146.65478 3.73987 1.97254 -146.76844 519.71047
5160.0000 -151.26998 -147.56467 3.70531 1.94138 -147.24602 485.62700
5165.0000 -151.03141 -146.66316 4.36825 1.97661 -146.70609 539.75550
5170.0000 -151.20962 -147.22209 3.98752 1.97932 -146.66450 536.63432
5175.0000 -150.23881 -146.68828 3.55052 1.94846 -147.13747 504.26485
5180.0000 -149.82636 -145.94695 3.87941 1.98046 -146.64717 527.36537
5185.0000 -150.47686 -146.79398 3.68288 1.96302 -146.91433 509.21002
5190.0000 -150.08841 -145.55264 4.53577 1.99811 -146.37658 517.95893
5195.0000 -149.36676 -145.64484 3.72193 2.06515 -145.34918 566.73986
5200.0000 -148.57570 -144.59295 3.98275 2.08236 -145.08533 560.03825
5205.0000 -149.93375 -145.51061 4.42314 2.09487 -144.89365 590.46827
5210.0000 -148.57294 -144.00073 4.57221 2.07889 -145.13849 533.16469
5215.0000 -148.41213 -144.29203 4.12010 2.14844 -144.07266 576.22636
5220.0000 -149.20143 -145.05850 4.14294 2.12784 -144.38838 555.54730
5225.0000 -149.21802 -144.77876 4.43926 2.10322 -144.76572 537.64172
5230.0000 -149.71743 -145.70456 4.01287 2.08832 -144.99400 547.42719
5235.0000 -150.18805 -146.11479 4.07327 2.04880 -145.59973 532.06570
5240.0000 -149.02548 -145.36719 3.65829 2.02774 -145.92240 515.39740
5245.0000 -148.76705 -144.08493 4.68212 2.10570 -144.72760 581.91320
5250.0000 -148.86771 -144.78680 4.08090 2.11306 -144.61477 592.56764
FREEZING PROCESS: loop number 22 T-loop= 531.00000000000000
main_MD> interactions number 22 at Temperature= 531.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.63812 3.35628 0.96817
force_rgl> df(natom) -2.96233 -1.21914 -0.92099
5255.0000 -149.21854 -145.14484 4.07370 2.07572 -145.18712 537.90073
5260.0000 -149.24619 -145.47448 3.77171 2.08079 -145.10936 546.10000
5265.0000 -150.00205 -145.90263 4.09942 2.04322 -145.68516 526.41054
5270.0000 -150.67662 -147.41019 3.26644 1.97857 -146.67605 495.07196
5275.0000 -150.71283 -145.96369 4.74913 1.98000 -146.65422 497.73712
5280.0000 -150.07822 -146.51112 3.56710 2.00856 -146.21636 518.74698
5285.0000 -151.02007 -147.15607 3.86400 1.98346 -146.60114 496.45188
5290.0000 -149.96078 -145.48617 4.47461 1.98102 -146.63849 488.08506
5295.0000 -149.83253 -145.33565 4.49688 2.07234 -145.23900 557.44395
5300.0000 -149.93807 -145.50790 4.43017 2.05084 -145.56849 542.53079
5305.0000 -150.28173 -146.34824 3.93348 2.03461 -145.81724 535.63887
5310.0000 -150.16424 -145.62811 4.53614 2.01068 -146.18388 518.79037
5315.0000 -149.76586 -145.92257 3.84329 2.06076 -145.41645 580.30000
5320.0000 -149.92456 -145.62279 4.30177 2.01729 -146.08265 526.62228
5325.0000 -150.59045 -146.56286 4.02758 1.98868 -146.52110 499.15170
5330.0000 -149.44454 -145.39823 4.04632 2.05088 -145.56784 550.78023
5335.0000 -150.17762 -145.96973 4.20789 2.07625 -145.17898 576.23001
5340.0000 -149.46889 -145.08785 4.38105 2.01822 -146.06839 513.34078
5345.0000 -149.93045 -145.78780 4.14265 2.06474 -145.35539 551.95056
5350.0000 -150.26275 -146.09063 4.17212 1.99579 -146.41208 509.82746
5355.0000 -150.31072 -146.45577 3.85496 2.02784 -145.92087 534.55072
5360.0000 -150.42818 -145.92163 4.50656 2.00973 -146.19854 532.72648
5365.0000 -150.53376 -146.83019 3.70357 1.97885 -146.67174 501.19299
5370.0000 -151.44390 -147.48756 3.95634 1.96294 -146.91566 496.22327
5375.0000 -151.06250 -147.44196 3.62053 1.93316 -147.37206 485.39673
5380.0000 -150.78467 -147.07033 3.71434 1.93552 -147.33580 487.27453
5385.0000 -150.31968 -146.40742 3.91226 1.99119 -146.48271 518.86025
5390.0000 -150.07278 -146.34360 3.72919 2.01608 -146.10112 532.78697
5395.0000 -150.33215 -145.54888 4.78327 2.04505 -145.65715 534.01902
5400.0000 -149.86145 -145.41509 4.44636 2.04090 -145.72072 539.42030
5405.0000 -149.71272 -145.24434 4.46838 2.05871 -145.44786 565.86859
5410.0000 -150.75476 -146.25540 4.49935 2.05259 -145.54155 544.62062
5415.0000 -151.10913 -146.98845 4.12069 1.97343 -146.75489 513.58983
5420.0000 -150.37137 -145.67937 4.69201 1.98922 -146.51288 515.48173
5425.0000 -150.53273 -146.33817 4.19456 2.01664 -146.09252 537.27413
5430.0000 -150.14133 -145.85515 4.28618 2.01524 -146.11400 530.02158
5435.0000 -149.37708 -145.39505 3.98203 2.05584 -145.49182 562.69304
5440.0000 -150.63061 -146.40999 4.22063 2.01109 -146.17764 514.38106
5445.0000 -150.75522 -146.91757 3.83765 1.94599 -147.17542 476.36005
5450.0000 -150.94067 -146.12804 4.81263 2.00055 -146.33915 519.49718
5455.0000 -150.39711 -146.04082 4.35629 2.03480 -145.81432 552.22210
5460.0000 -149.97300 -145.05215 4.92085 2.04904 -145.59597 570.47666
5465.0000 -150.54846 -146.89491 3.65355 1.99105 -146.48473 531.75175
5470.0000 -149.82105 -145.60138 4.21966 1.97813 -146.68277 512.28213
5475.0000 -149.33896 -145.33313 4.00583 2.04813 -145.60996 546.82498
5480.0000 -149.64440 -145.47176 4.17265 2.05778 -145.46208 516.56933
5485.0000 -149.31295 -145.54497 3.76798 2.05533 -145.49957 528.76658
5490.0000 -149.39862 -144.90373 4.49488 2.07655 -145.17442 553.12230
5495.0000 -150.28612 -145.85692 4.42920 2.07881 -145.13980 535.55070
5500.0000 -150.09629 -146.80599 3.29030 2.01480 -146.12075 507.58994
FREEZING PROCESS: loop number 23 T-loop= 506.00000000000000
main_MD> interactions number 23 at Temperature= 506.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.56934 0.21192 1.04247
force_rgl> df(natom) 0.24924 4.84486 -0.69998
5505.0000 -150.79775 -147.22194 3.57581 1.94794 -147.14547 448.89854
5510.0000 -150.93277 -147.32256 3.61021 1.93425 -147.35533 462.45697
5515.0000 -151.41858 -147.53579 3.88280 1.94065 -147.25727 481.28098
5520.0000 -150.83058 -147.25685 3.57372 1.94184 -147.23906 487.76371
5525.0000 -150.52449 -147.00756 3.51693 1.96604 -146.86810 500.12463
5530.0000 -151.12599 -147.39940 3.72659 1.94284 -147.22359 479.90074
5535.0000 -151.59241 -147.73230 3.86011 1.93827 -147.29372 502.12768
5540.0000 -151.30655 -147.46792 3.83862 1.91633 -147.62998 459.73182
5545.0000 -151.49007 -147.86800 3.62207 1.91144 -147.70498 449.65173
5550.0000 -151.44505 -147.31814 4.12691 1.94167 -147.24155 498.37706
5555.0000 -150.58371 -146.68460 3.89911 1.98201 -146.62328 526.47585
5560.0000 -150.44598 -146.35535 4.09064 1.98197 -146.62393 523.88019
5565.0000 -150.53064 -145.99550 4.53514 2.02708 -145.93265 549.77381
5570.0000 -150.94332 -146.72413 4.21919 1.99183 -146.47283 525.97847
5575.0000 -151.02965 -147.74966 3.27999 1.91826 -147.60041 473.65972
5580.0000 -150.72720 -147.84329 2.88390 1.89107 -148.01713 449.40682
5585.0000 -151.25021 -147.57504 3.67517 1.91014 -147.72479 460.04772
5590.0000 -151.34040 -147.12127 4.21913 1.93689 -147.31493 480.29208
5595.0000 -150.60892 -146.79836 3.81057 1.98349 -146.60064 514.97684
5600.0000 -150.23667 -146.96413 3.27254 1.97509 -146.72946 484.88752
5605.0000 -150.32057 -146.88266 3.43791 1.96774 -146.84208 489.58320
5610.0000 -150.47699 -146.21274 4.26424 2.00486 -146.27313 535.55917
5615.0000 -150.18625 -146.61963 3.56662 2.03711 -145.77891 566.49291
5620.0000 -149.83684 -145.33575 4.50109 2.01892 -146.05764 538.16024
5625.0000 -151.79411 -146.61438 5.17974 2.04102 -145.71888 577.32620
5630.0000 -151.22306 -147.06638 4.15667 1.95921 -146.97274 509.38556
5635.0000 -150.65199 -147.25503 3.39696 1.95842 -146.98485 485.40255
5640.0000 -151.26204 -147.44870 3.81334 1.94282 -147.22403 499.86678
5645.0000 -150.91768 -147.67222 3.24546 1.88531 -148.10531 444.20764
5650.0000 -150.75186 -147.29014 3.46173 1.90513 -147.80166 441.86854
5655.0000 -150.71085 -146.69377 4.01707 1.94244 -147.22987 482.69239
5660.0000 -150.51381 -146.40774 4.10607 1.96332 -146.90981 474.43104
5665.0000 -149.56078 -145.70621 3.85457 2.01992 -146.04231 530.38864
5670.0000 -150.02907 -145.74296 4.28611 2.03286 -145.84407 532.28883
5675.0000 -150.20710 -145.53530 4.67180 2.02437 -145.97417 509.75840
5680.0000 -149.46042 -145.65539 3.80503 2.03675 -145.78440 501.46356
5685.0000 -150.38763 -146.43088 3.95675 2.02830 -145.91386 523.00870
5690.0000 -150.30405 -146.19873 4.10532 2.02425 -145.97593 515.76006
5695.0000 -150.21403 -146.30857 3.90545 1.98857 -146.52280 470.79939
5700.0000 -149.75382 -145.83894 3.91488 2.00793 -146.22614 491.69474
5705.0000 -150.42726 -146.29930 4.12796 2.01458 -146.12409 517.68684
5710.0000 -149.56899 -144.77512 4.79387 2.07565 -145.18819 576.44761
5715.0000 -150.38227 -147.00050 3.38177 2.06880 -145.29322 564.79903
5720.0000 -149.89924 -146.54649 3.35275 2.01035 -146.18893 504.69782
5725.0000 -149.66804 -145.50474 4.16330 2.02016 -146.03859 528.34648
5730.0000 -150.26650 -146.51273 3.75378 2.06286 -145.38429 566.69322
5735.0000 -149.35934 -145.20376 4.15558 2.03383 -145.82910 531.40106
5740.0000 -150.25242 -146.13708 4.11534 2.04634 -145.63740 530.18745
5745.0000 -149.16515 -145.34319 3.82196 2.02549 -145.95697 504.71669
5750.0000 -149.18338 -145.36096 3.82242 2.05290 -145.53689 528.04174
FREEZING PROCESS: loop number 24 T-loop= 481.00000000000000
main_MD> interactions number 24 at Temperature= 481.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.15091 1.35703 1.71624
force_rgl> df(natom) 0.85604 0.91920 0.34494
5755.0000 -150.18003 -146.13372 4.04632 2.03687 -145.78256 518.76212
5760.0000 -149.52365 -146.16326 3.36038 2.00431 -146.28153 488.35456
5765.0000 -150.69329 -146.49855 4.19474 2.00421 -146.28317 473.73552
5770.0000 -149.44489 -145.65986 3.78503 2.03216 -145.85473 503.90440
5775.0000 -149.62116 -145.14466 4.47650 2.07578 -145.18626 548.11132
5780.0000 -148.42548 -143.86083 4.56465 2.11609 -144.56839 553.95918
5785.0000 -149.58843 -145.22178 4.36666 2.09233 -144.93262 529.71639
5790.0000 -149.32011 -146.08638 3.23373 2.03426 -145.82255 482.42980
5795.0000 -149.46577 -145.49061 3.97516 2.04919 -145.59378 509.44817
5800.0000 -150.76216 -146.70699 4.05517 2.02416 -145.97727 507.98417
5805.0000 -151.20821 -147.82898 3.37923 1.95978 -146.96404 459.98343
5810.0000 -150.65383 -147.69439 2.95944 1.93611 -147.32684 456.22782
5815.0000 -150.45593 -146.63405 3.82188 1.94004 -147.26653 455.25805
5820.0000 -150.67577 -146.97711 3.69866 1.97562 -146.72125 469.95558
5825.0000 -150.44221 -146.78134 3.66087 1.98893 -146.51726 478.34062
5830.0000 -150.40500 -146.95405 3.45094 1.94665 -147.16528 441.70622
5835.0000 -149.91919 -146.06472 3.85446 1.98098 -146.63912 465.68723
5840.0000 -149.65813 -145.77219 3.88593 2.01127 -146.17491 498.55278
5845.0000 -150.20093 -147.01757 3.18336 2.00062 -146.33818 476.12427
5850.0000 -150.49588 -146.94899 3.54689 1.94767 -147.14959 439.49272
5855.0000 -150.18907 -146.35086 3.83821 1.98294 -146.60905 471.43632
5860.0000 -150.13726 -146.59246 3.54480 1.99941 -146.35665 485.21497
5865.0000 -151.48520 -147.72572 3.75948 1.94558 -147.18175 443.03883
5870.0000 -150.83625 -146.77573 4.06053 1.94779 -147.14779 477.77098
5875.0000 -151.25150 -147.42636 3.82514 1.95963 -146.96641 476.11836
5880.0000 -150.90631 -146.87715 4.02916 1.96226 -146.92598 479.84853
5885.0000 -150.95350 -146.34470 4.60880 1.98751 -146.53907 503.23893
5890.0000 -149.76699 -145.63109 4.13590 2.00850 -146.21729 497.25379
5895.0000 -149.61583 -146.34288 3.27295 2.03031 -145.88312 498.47993
5900.0000 -149.58021 -145.69541 3.88480 2.02704 -145.93317 481.96306
5905.0000 -149.31819 -145.62980 3.68839 2.03442 -145.82007 502.00909
5910.0000 -150.28578 -146.60809 3.67769 2.00905 -146.20898 466.22245
5915.0000 -149.78908 -145.62819 4.16089 2.01349 -146.14088 472.09989
5920.0000 -149.64292 -145.85024 3.79268 2.05542 -145.49832 523.45392
5925.0000 -149.92490 -147.24643 2.67847 1.98181 -146.62639 453.39779
5930.0000 -150.58176 -147.31453 3.26723 1.94261 -147.22719 409.46599
5935.0000 -149.82995 -146.41454 3.41541 1.98668 -146.55175 452.18914
5940.0000 -150.59093 -147.01214 3.57879 1.95738 -147.00082 444.59579
5945.0000 -150.78913 -146.85003 3.93910 1.96432 -146.89444 448.56604
5950.0000 -151.76090 -148.18002 3.58088 1.91385 -147.66800 428.54258
5955.0000 -149.99198 -146.68022 3.31175 1.96639 -146.86268 479.10039
5960.0000 -150.14070 -146.47857 3.66213 2.00214 -146.31480 504.62874
5965.0000 -150.59696 -147.10620 3.49076 1.97970 -146.65879 482.94528
5970.0000 -151.13613 -147.30945 3.82669 1.94709 -147.15853 456.14684
5975.0000 -150.40194 -146.89538 3.50657 1.97729 -146.69573 482.89113
5980.0000 -150.87258 -146.95640 3.91618 1.95725 -147.00285 469.91649
5985.0000 -150.11023 -146.87391 3.23633 1.95449 -147.04505 493.54998
5990.0000 -150.32103 -145.99074 4.33029 2.01846 -146.06474 546.59156
5995.0000 -150.45348 -146.20755 4.24593 2.01400 -146.13309 537.29688
6000.0000 -151.30855 -146.30054 5.00801 1.97801 -146.68463 516.96200
FREEZING PROCESS: loop number 25 T-loop= 456.00000000000000
main_MD> interactions number 25 at Temperature= 456.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.45385 -3.09191 -1.91396
force_rgl> df(natom) -1.20759 -0.56679 0.46203
6005.0000 -150.66444 -147.30477 3.35967 1.96354 -146.90637 499.05933
6010.0000 -151.34255 -148.16000 3.18255 1.88838 -148.05834 432.31720
6015.0000 -151.37432 -147.82611 3.54822 1.90547 -147.79639 435.94214
6020.0000 -151.57231 -147.08690 4.48540 1.92398 -147.51275 474.23597
6025.0000 -150.99483 -147.66081 3.33402 1.92452 -147.50441 452.35453
6030.0000 -150.78144 -147.44615 3.33530 1.91716 -147.61717 451.30483
6035.0000 -150.02060 -146.66229 3.35831 1.95024 -147.11031 475.66028
6040.0000 -151.28693 -147.86495 3.42198 1.93353 -147.36628 458.27241
6045.0000 -151.70886 -147.84197 3.86689 1.90983 -147.72963 444.18530
6050.0000 -150.50897 -147.31182 3.19716 1.90450 -147.81126 420.30113
6055.0000 -150.27651 -146.63097 3.64555 1.95636 -147.01648 471.24700
6060.0000 -150.63605 -147.40127 3.23479 1.95609 -147.02061 472.00750
6065.0000 -150.65992 -147.54795 3.11196 1.90032 -147.87537 421.04309
6070.0000 -151.18362 -147.30875 3.87488 1.92969 -147.42522 443.63786
6075.0000 -150.89030 -147.01318 3.87711 1.95214 -147.08116 470.72322
6080.0000 -150.85536 -147.77995 3.07542 1.93636 -147.32302 457.31034
6085.0000 -150.83023 -146.47947 4.35076 1.95369 -147.05732 468.55913
6090.0000 -150.05824 -146.44043 3.61780 1.98162 -146.62924 483.96507
6095.0000 -150.29488 -146.89278 3.40211 1.98798 -146.53182 478.60672
6100.0000 -151.21544 -147.24932 3.96613 1.92899 -147.43596 452.96320
6105.0000 -151.10071 -147.92379 3.17692 1.91468 -147.65525 444.26426
6110.0000 -150.71457 -146.92549 3.78908 1.93625 -147.32473 459.56925
6115.0000 -151.04935 -146.80421 4.24515 1.96671 -146.85782 472.80218
6120.0000 -150.80710 -147.66590 3.14120 1.95680 -147.00977 468.91415
6125.0000 -151.69988 -148.33066 3.36922 1.87376 -148.28246 400.10856
6130.0000 -151.23105 -147.84948 3.38157 1.87469 -148.26809 406.45291
6135.0000 -150.40550 -147.14007 3.26544 1.91201 -147.69615 433.38071
6140.0000 -150.65978 -146.95315 3.70663 1.94747 -147.15266 469.38523
6145.0000 -150.39107 -147.43670 2.95437 1.96153 -146.93723 478.12107
6150.0000 -150.50904 -147.07232 3.43672 1.96290 -146.91625 480.23926
6155.0000 -150.49658 -146.86231 3.63427 1.95497 -147.03778 454.23371
6160.0000 -150.60595 -147.40054 3.20541 1.94346 -147.21413 427.66561
6165.0000 -150.40912 -146.61379 3.79534 1.96424 -146.89568 447.50365
6170.0000 -150.28632 -147.32699 2.95933 1.94805 -147.14380 421.77873
6175.0000 -149.61181 -145.37629 4.23551 1.98457 -146.58415 455.65751
6180.0000 -149.71029 -146.10602 3.60427 2.02142 -146.01937 485.75180
6185.0000 -150.06313 -146.69693 3.36620 1.99228 -146.46596 459.96833
6190.0000 -150.14745 -146.43837 3.70908 1.97504 -146.73009 466.00095
6195.0000 -150.63723 -146.97813 3.65910 1.95999 -146.96076 450.41531
6200.0000 -148.97257 -144.97051 4.00206 2.04845 -145.60501 501.89036
6205.0000 -149.93867 -146.11996 3.81871 2.05447 -145.51274 517.48704
6210.0000 -150.36779 -147.00036 3.36743 1.97749 -146.69267 449.38909
6215.0000 -149.88813 -146.63492 3.25321 1.96833 -146.83306 437.55831
6220.0000 -150.99800 -146.94623 4.05177 1.99794 -146.37918 481.28885
6225.0000 -150.76011 -147.76515 2.99496 1.93989 -147.26887 443.93432
6230.0000 -150.88677 -147.15661 3.73016 1.92638 -147.47588 434.74050
6235.0000 -150.28718 -147.18485 3.10234 1.95065 -147.10402 442.31089
6240.0000 -150.93523 -147.19008 3.74515 1.94441 -147.19960 423.54423
6245.0000 -149.95595 -146.79422 3.16173 1.92384 -147.51494 418.23539
6250.0000 -150.56015 -146.82869 3.73146 1.96368 -146.90431 468.97301
FREEZING PROCESS: loop number 26 T-loop= 431.00000000000000
main_MD> interactions number 26 at Temperature= 431.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.03378 -1.20734 0.09937
force_rgl> df(natom) 0.90589 -0.54343 1.96420
6255.0000 -151.30327 -147.62197 3.68131 1.95339 -147.06201 471.76548
6260.0000 -150.98920 -148.29282 2.69637 1.87637 -148.24245 411.79875
6265.0000 -150.61405 -147.34474 3.26932 1.88996 -148.03415 420.24535
6270.0000 -151.18328 -146.41405 4.76923 1.97926 -146.66554 481.61880
6275.0000 -151.68245 -147.90440 3.77805 1.90969 -147.73175 432.91245
6280.0000 -151.29943 -146.65709 4.64234 1.94038 -147.26142 463.72400
6285.0000 -151.55450 -148.21717 3.33733 1.93426 -147.35511 460.59109
6290.0000 -151.01236 -148.10292 2.90943 1.90884 -147.74479 438.94630
6295.0000 -151.09068 -147.99331 3.09737 1.90510 -147.80202 438.69388
6300.0000 -151.34059 -148.63286 2.70773 1.88770 -148.06883 412.34521
6305.0000 -151.41965 -147.84210 3.57755 1.86141 -148.47168 398.55303
6310.0000 -151.26896 -148.05080 3.21816 1.90069 -147.86968 432.13774
6315.0000 -152.22622 -148.80901 3.41721 1.87017 -148.33745 412.44152
6320.0000 -151.89435 -148.36019 3.53416 1.84342 -148.74742 403.45279
6325.0000 -151.72552 -149.00906 2.71646 1.83696 -148.84637 403.99994
6330.0000 -152.31644 -148.85334 3.46309 1.85042 -148.64015 419.48976
6335.0000 -151.43280 -148.19813 3.23467 1.83738 -148.83997 392.06519
6340.0000 -151.27393 -147.54480 3.72913 1.89657 -147.93283 439.15776
6345.0000 -151.58180 -148.05313 3.52866 1.90254 -147.84131 444.26763
6350.0000 -151.45841 -147.88237 3.57604 1.90588 -147.79009 453.37231
6355.0000 -151.66741 -147.90999 3.75742 1.90098 -147.86524 447.75361
6360.0000 -151.52092 -148.16193 3.35900 1.88304 -148.14022 421.40082
6365.0000 -151.40101 -148.28419 3.11682 1.87416 -148.27630 415.65416
6370.0000 -151.40091 -148.02843 3.37247 1.89432 -147.96729 435.08387
6375.0000 -151.33785 -148.28854 3.04931 1.87262 -148.29988 409.44407
6380.0000 -151.65781 -147.87383 3.78398 1.88985 -148.03581 424.68042
6385.0000 -150.67563 -147.22607 3.44956 1.93081 -147.40807 471.40707
6390.0000 -151.23976 -148.43999 2.79977 1.91275 -147.68482 456.36928
6395.0000 -151.55500 -148.17346 3.38153 1.86428 -148.42772 410.49135
6400.0000 -151.25092 -148.83897 2.41195 1.87300 -148.29412 424.90260
6405.0000 -151.30239 -148.11990 3.18249 1.86008 -148.49211 413.91852
6410.0000 -151.73762 -148.63326 3.10437 1.86536 -148.41113 406.83902
6415.0000 -151.56880 -147.72147 3.84733 1.87504 -148.26280 420.28759
6420.0000 -151.49004 -148.41557 3.07447 1.90425 -147.81511 442.45942
6425.0000 -151.70459 -148.41306 3.29153 1.84790 -148.67872 394.17647
6430.0000 -151.30741 -147.88337 3.42404 1.90125 -147.86104 437.68770
6435.0000 -151.24880 -147.53662 3.71218 1.91638 -147.62926 447.05401
6440.0000 -150.76820 -147.09491 3.67329 1.95151 -147.09086 470.54892
6445.0000 -151.62531 -147.86510 3.76020 1.91102 -147.71142 429.24970
6450.0000 -151.74636 -148.35144 3.39492 1.88997 -148.03395 418.78865
6455.0000 -151.85264 -148.67551 3.17713 1.86045 -148.48643 403.12688
6460.0000 -152.09392 -149.14509 2.94883 1.83096 -148.93836 395.08311
6465.0000 -151.91289 -148.56944 3.34345 1.82755 -148.99061 383.92557
6470.0000 -150.85952 -148.13287 2.72665 1.87196 -148.30991 399.41425
6475.0000 -151.68832 -148.09593 3.59239 1.87339 -148.28802 429.41555
6480.0000 -151.89470 -148.11368 3.78102 1.88018 -148.18396 443.32224
6485.0000 -151.75330 -148.77333 2.97997 1.85675 -148.54303 421.96761
6490.0000 -151.72382 -148.38001 3.34382 1.86028 -148.48893 410.12147
6495.0000 -151.45321 -147.85372 3.59949 1.88231 -148.15144 439.29931
6500.0000 -151.69224 -148.58676 3.10548 1.87541 -148.25718 437.50881
FREEZING PROCESS: loop number 27 T-loop= 406.00000000000000
main_MD> interactions number 27 at Temperature= 406.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.79944 -0.72802 -0.75502
force_rgl> df(natom) -1.79409 1.70743 0.06871
6505.0000 -151.24915 -147.86635 3.38280 1.87745 -148.22589 430.35788
6510.0000 -151.86229 -148.96511 2.89718 1.88411 -148.12377 428.37770
6515.0000 -152.04623 -149.21009 2.83614 1.82000 -149.10640 375.95738
6520.0000 -152.66198 -149.48668 3.17530 1.80211 -149.38055 362.93075
6525.0000 -151.60191 -147.96751 3.63440 1.83062 -148.94351 388.23771
6530.0000 -152.25549 -149.26042 2.99506 1.84600 -148.70788 396.45972
6535.0000 -151.95418 -148.67488 3.27929 1.83713 -148.84377 393.79937
6540.0000 -152.40582 -149.27004 3.13579 1.83371 -148.89617 388.76019
6545.0000 -151.44337 -148.70036 2.74302 1.83518 -148.87371 392.21576
6550.0000 -151.95111 -149.19056 2.76056 1.81512 -149.18108 368.04821
6555.0000 -152.57953 -149.52406 3.05547 1.82900 -148.96846 389.33694
6560.0000 -151.93814 -148.96267 2.97547 1.80982 -149.26243 378.30005
6565.0000 -151.84673 -148.62932 3.21742 1.81017 -149.25697 378.66853
6570.0000 -151.90681 -148.44527 3.46154 1.87219 -148.30641 417.14167
6575.0000 -152.22830 -149.06194 3.16636 1.87503 -148.26300 432.09333
6580.0000 -152.70819 -149.24211 3.46608 1.81642 -149.16125 381.75421
6585.0000 -151.89549 -148.64470 3.25079 1.84317 -148.75126 410.42930
6590.0000 -152.13423 -148.81222 3.32200 1.85682 -148.54197 420.39518
6595.0000 -151.80040 -148.88563 2.91477 1.83351 -148.89928 402.69020
6600.0000 -151.80889 -149.19050 2.61839 1.82613 -149.01237 388.80116
6605.0000 -152.38909 -149.18180 3.20729 1.80548 -149.32887 377.25876
6610.0000 -151.43896 -148.32601 3.11295 1.86039 -148.48736 421.29545
6615.0000 -152.19112 -148.72372 3.46740 1.84880 -148.66494 412.65270
6620.0000 -152.30907 -148.83116 3.47791 1.82398 -149.04527 389.76276
6625.0000 -152.13858 -149.08224 3.05634 1.82681 -149.00199 398.29169
6630.0000 -152.50390 -149.49250 3.01140 1.80468 -149.34108 376.24617
6635.0000 -151.71695 -148.42834 3.28861 1.83404 -148.89115 408.38882
6640.0000 -152.32201 -148.58974 3.73226 1.85091 -148.63253 416.34610
6645.0000 -151.56621 -148.67824 2.88797 1.85392 -148.58651 420.00846
6650.0000 -151.77549 -148.60857 3.16692 1.85936 -148.50315 420.96857
6655.0000 -151.78197 -148.14158 3.64039 1.86786 -148.37286 409.37750
6660.0000 -151.09307 -147.54422 3.54885 1.90886 -147.74448 441.68900
6665.0000 -151.50774 -147.89197 3.61577 1.92370 -147.51707 464.37319
6670.0000 -151.72262 -148.78712 2.93550 1.87224 -148.30576 420.61598
6675.0000 -151.62568 -148.73260 2.89308 1.83178 -148.92575 383.49690
6680.0000 -151.92360 -148.38397 3.53963 1.83914 -148.81292 386.71353
6685.0000 -151.17388 -148.37997 2.79391 1.86916 -148.35294 405.88006
6690.0000 -151.77602 -148.39807 3.37795 1.88547 -148.10299 426.59348
6695.0000 -151.71144 -148.79324 2.91820 1.86817 -148.36801 418.39435
6700.0000 -152.52784 -149.54102 2.98682 1.81526 -149.17904 368.68352
6705.0000 -151.41032 -148.31731 3.09300 1.82524 -149.02608 370.83815
6710.0000 -151.27135 -147.55829 3.71306 1.90717 -147.77033 440.99052
6715.0000 -150.74556 -147.49022 3.25534 1.93493 -147.34483 470.84459
6720.0000 -151.72602 -147.92820 3.79781 1.90383 -147.82148 440.37440
6725.0000 -151.13982 -148.27429 2.86553 1.88374 -148.12940 423.40606
6730.0000 -151.67967 -148.58484 3.09483 1.85070 -148.63581 392.34765
6735.0000 -150.66656 -147.27260 3.39396 1.92020 -147.57064 432.92019
6740.0000 -150.79957 -147.17477 3.62480 1.94586 -147.17742 468.27057
6745.0000 -151.52502 -148.45629 3.06873 1.92145 -147.55146 446.61239
6750.0000 -151.93958 -148.14663 3.79295 1.85802 -148.52359 382.32106
FREEZING PROCESS: loop number 28 T-loop= 381.00000000000000
main_MD> interactions number 28 at Temperature= 381.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.34581 -0.75352 -0.44350
force_rgl> df(natom) 0.49061 1.01617 0.06649
6755.0000 -152.00547 -149.31083 2.69464 1.83881 -148.81801 386.41219
6760.0000 -152.15489 -149.10215 3.05274 1.81822 -149.13357 367.72366
6765.0000 -152.46237 -149.50626 2.95611 1.80834 -149.28510 361.63771
6770.0000 -152.38625 -149.18688 3.19937 1.78781 -149.59976 344.35897
6775.0000 -151.43368 -148.21829 3.21539 1.85945 -148.50174 404.19886
6780.0000 -152.12263 -148.70230 3.42033 1.85467 -148.57505 403.09382
6785.0000 -151.41560 -148.73089 2.68471 1.82781 -148.98671 374.95451
6790.0000 -152.08570 -149.38692 2.69878 1.80609 -149.31949 360.69053
6795.0000 -152.32707 -149.54898 2.77809 1.78995 -149.56682 337.78506
6800.0000 -151.94774 -149.02930 2.91844 1.82598 -149.01471 375.80251
6805.0000 -152.05771 -149.46616 2.59155 1.82430 -149.04044 370.30298
6810.0000 -152.33370 -148.96980 3.36391 1.82678 -149.00250 365.48079
6815.0000 -152.38751 -149.40414 2.98337 1.82486 -149.03185 372.29893
6820.0000 -152.05136 -148.79596 3.25540 1.81605 -149.16687 365.48209
6825.0000 -151.88309 -148.96947 2.91362 1.84208 -148.76793 397.28574
6830.0000 -151.23829 -147.79895 3.43934 1.85682 -148.54201 410.17807
6835.0000 -151.27327 -148.54671 2.72657 1.87244 -148.30261 412.64532
6840.0000 -151.51234 -148.48090 3.03144 1.86504 -148.41602 408.77799
6845.0000 -151.03170 -148.10241 2.92929 1.88199 -148.15626 421.83123
6850.0000 -151.54611 -148.54683 2.99927 1.85598 -148.55493 394.85736
6855.0000 -151.33274 -148.28285 3.04989 1.85423 -148.58169 390.15845
6860.0000 -151.92523 -148.69538 3.22985 1.85284 -148.60308 387.67743
6865.0000 -151.71526 -148.64819 3.06707 1.84169 -148.77396 375.75108
6870.0000 -151.20107 -148.65982 2.54125 1.83365 -148.89713 365.73304
6875.0000 -151.45643 -147.99681 3.45962 1.86871 -148.35985 392.15176
6880.0000 -151.24156 -147.86248 3.37908 1.89575 -147.94545 428.31650
6885.0000 -152.11827 -148.81203 3.30623 1.85974 -148.49728 405.23638
6890.0000 -151.89098 -148.65404 3.23694 1.84119 -148.78153 390.87103
6895.0000 -151.71449 -148.63808 3.07640 1.86245 -148.45568 397.78393
6900.0000 -151.69794 -148.55955 3.13839 1.86139 -148.47203 401.62794
6905.0000 -151.40018 -148.61668 2.78350 1.84255 -148.76078 382.30063
6910.0000 -151.95742 -148.89132 3.06610 1.84119 -148.78153 381.14160
6915.0000 -152.72488 -149.55856 3.16632 1.79801 -149.44330 351.91047
6920.0000 -152.74841 -149.39401 3.35440 1.79789 -149.44526 366.33363
6925.0000 -151.84939 -148.94548 2.90391 1.81996 -149.10699 389.28794
6930.0000 -152.28575 -149.00666 3.27909 1.82571 -149.01887 396.89339
6935.0000 -151.46588 -148.57438 2.89150 1.85563 -148.56021 422.69463
6940.0000 -152.37824 -149.39371 2.98453 1.85989 -148.49499 425.63645
6945.0000 -152.88333 -149.75943 3.12390 1.81249 -149.22146 380.83576
6950.0000 -152.06022 -148.97963 3.08059 1.79382 -149.50763 361.72695
6955.0000 -151.62761 -148.94353 2.68408 1.81523 -149.17939 381.12376
6960.0000 -151.86158 -148.81468 3.04690 1.82429 -149.04055 390.79209
6965.0000 -151.79944 -148.90956 2.88989 1.83607 -148.86002 402.23739
6970.0000 -152.24543 -149.25525 2.99018 1.83077 -148.94133 395.16809
6975.0000 -152.84591 -149.76713 3.07879 1.78516 -149.64030 357.23607
6980.0000 -152.60338 -149.53838 3.06500 1.77766 -149.75520 349.15335
6985.0000 -152.43320 -149.45036 2.98284 1.78628 -149.62317 361.13479
6990.0000 -152.11568 -148.70595 3.40972 1.79801 -149.44329 367.14965
6995.0000 -151.95397 -149.28128 2.67269 1.83499 -148.87664 399.17206
7000.0000 -151.95305 -149.02065 2.93240 1.80922 -149.27150 376.27041
FREEZING PROCESS: loop number 29 T-loop= 356.00000000000000
main_MD> interactions number 29 at Temperature= 356.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.65548 -2.02340 -0.48068
force_rgl> df(natom) 2.36416 0.21154 -0.02043
7005.0000 -152.36683 -149.78294 2.58389 1.80038 -149.40708 373.98223
7010.0000 -152.37545 -149.79090 2.58454 1.77677 -149.76883 351.05689
7015.0000 -151.84259 -149.08861 2.75398 1.80441 -149.34525 375.08034
7020.0000 -152.38213 -149.81496 2.56717 1.79025 -149.56231 359.77918
7025.0000 -151.91198 -149.32053 2.59145 1.78622 -149.62407 359.23745
7030.0000 -152.27205 -149.23112 3.04094 1.81093 -149.24532 376.60589
7035.0000 -152.50209 -149.24039 3.26170 1.82687 -149.00103 396.61498
7040.0000 -152.47893 -149.24693 3.23200 1.81726 -149.14837 395.87481
7045.0000 -152.09282 -149.35747 2.73535 1.82548 -149.02235 385.14282
7050.0000 -152.60029 -149.86257 2.73772 1.79080 -149.55391 363.05362
7055.0000 -152.48392 -149.68779 2.79613 1.76131 -150.00583 333.91207
7060.0000 -152.63571 -149.78819 2.84752 1.76621 -149.93073 341.97588
7065.0000 -152.64320 -149.55317 3.09003 1.80776 -149.29389 374.39711
7070.0000 -151.64121 -148.54452 3.09669 1.83430 -148.88712 397.73826
7075.0000 -152.09745 -149.53149 2.56596 1.81596 -149.16833 383.87652
7080.0000 -151.91986 -149.61613 2.30373 1.77723 -149.76187 348.79651
7085.0000 -152.87685 -150.36965 2.50720 1.76738 -149.91274 337.37543
7090.0000 -152.14209 -149.82093 2.32116 1.77616 -149.77830 350.26756
7095.0000 -152.39007 -149.66741 2.72266 1.76862 -149.89377 334.67002
7100.0000 -152.67371 -149.88434 2.78937 1.79816 -149.44109 362.55218
7105.0000 -152.61710 -149.94895 2.66816 1.77492 -149.79720 350.11462
7110.0000 -152.42281 -149.18618 3.23664 1.78639 -149.62146 358.90668
7115.0000 -152.34463 -149.58811 2.75652 1.80713 -149.30355 378.60682
7120.0000 -151.99660 -149.67066 2.32594 1.79401 -149.50460 362.20799
7125.0000 -152.48239 -150.04005 2.44235 1.78757 -149.60332 360.19611
7130.0000 -152.15825 -149.36782 2.79043 1.74472 -150.26010 318.58068
7135.0000 -152.78267 -149.90538 2.87729 1.77629 -149.77629 349.70033
7140.0000 -152.49434 -149.42728 3.06707 1.78155 -149.69558 351.10969
7145.0000 -152.33073 -149.54464 2.78609 1.79307 -149.51910 363.13221
7150.0000 -151.98307 -149.30543 2.67764 1.79370 -149.50936 366.14431
7155.0000 -152.05664 -149.55831 2.49833 1.81074 -149.24821 377.12563
7160.0000 -152.41495 -149.48440 2.93055 1.77828 -149.74582 346.49089
7165.0000 -152.08551 -149.54077 2.54474 1.77860 -149.74079 350.24376
7170.0000 -152.49905 -149.68625 2.81280 1.80135 -149.39212 367.48791
7175.0000 -152.30730 -149.27568 3.03162 1.79667 -149.46384 368.23932
7180.0000 -152.68681 -150.16508 2.52173 1.77244 -149.83524 343.67497
7185.0000 -152.84990 -150.14469 2.70520 1.73444 -150.41761 304.91393
7190.0000 -152.70580 -149.92913 2.77666 1.75352 -150.12528 325.47534
7195.0000 -152.51526 -149.62891 2.88635 1.78719 -149.60920 355.35330
7200.0000 -152.84402 -150.39901 2.44501 1.76831 -149.89848 340.07837
7205.0000 -152.70087 -150.00941 2.69145 1.75396 -150.11850 326.30453
7210.0000 -152.47878 -149.51624 2.96254 1.76057 -150.01718 335.68701
7215.0000 -152.01034 -149.32971 2.68064 1.79523 -149.48591 364.65855
7220.0000 -152.43615 -150.18412 2.25203 1.76740 -149.91246 340.53014
7225.0000 -151.97749 -149.62044 2.35705 1.77651 -149.77289 348.61510
7230.0000 -152.59735 -150.07468 2.52267 1.77878 -149.73801 349.46840
7235.0000 -152.40081 -149.17060 3.23021 1.79384 -149.50725 365.93465
7240.0000 -152.14030 -149.42673 2.71357 1.80933 -149.26989 377.65668
7245.0000 -152.36108 -149.37104 2.99004 1.79397 -149.50531 365.27275
7250.0000 -151.83178 -149.34770 2.48408 1.82228 -149.07138 388.74010
FREEZING PROCESS: loop number 30 T-loop= 331.00000000000000
main_MD> interactions number 30 at Temperature= 331.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.83645 1.53350 -0.31745
force_rgl> df(natom) -3.46111 -3.26560 -1.67489
7255.0000 -152.19621 -149.58169 2.61452 1.79903 -149.42776 365.79629
7260.0000 -152.48207 -149.55350 2.92857 1.78878 -149.58483 365.17081
7265.0000 -152.34024 -149.30458 3.03566 1.78488 -149.64456 354.17754
7270.0000 -152.53694 -149.87983 2.65712 1.78808 -149.59550 364.30524
7275.0000 -152.89195 -149.66724 3.22471 1.77097 -149.85777 346.03206
7280.0000 -152.75674 -149.88500 2.87174 1.76989 -149.87426 345.95290
7285.0000 -152.40493 -149.97319 2.43174 1.75483 -150.10507 329.78012
7290.0000 -152.37756 -150.06560 2.31196 1.75477 -150.10606 325.88822
7295.0000 -152.62827 -150.26892 2.35935 1.75792 -150.05782 331.68252
7300.0000 -153.09015 -150.54184 2.54831 1.75159 -150.15485 329.16172
7305.0000 -152.47462 -149.96264 2.51198 1.75208 -150.14736 326.85107
7310.0000 -152.63502 -149.72752 2.90750 1.76965 -149.87804 342.44884
7315.0000 -152.98380 -150.13983 2.84397 1.77115 -149.85509 343.17157
7320.0000 -152.33571 -149.82417 2.51155 1.76617 -149.93138 342.33408
7325.0000 -152.36700 -149.90800 2.45900 1.77241 -149.83576 343.35240
7330.0000 -152.55340 -150.34492 2.20848 1.75090 -150.16539 323.94558
7335.0000 -152.24397 -149.73568 2.50829 1.76608 -149.93268 339.14960
7340.0000 -152.56083 -150.55906 2.00177 1.74703 -150.22470 320.74941
7345.0000 -152.45515 -149.70823 2.74692 1.76320 -149.97681 338.34006
7350.0000 -152.64966 -149.75207 2.89759 1.76234 -149.99010 331.85246
7355.0000 -152.75579 -149.72171 3.03408 1.78233 -149.68369 352.35378
7360.0000 -152.48299 -150.07144 2.41156 1.76551 -149.94146 340.73546
7365.0000 -152.39919 -149.68712 2.71207 1.76567 -149.93894 337.37416
7370.0000 -152.28055 -149.83252 2.44802 1.76998 -149.87290 344.67501
7375.0000 -152.34306 -150.32685 2.01621 1.74725 -150.22125 323.34028
7380.0000 -152.64256 -150.32762 2.31494 1.73963 -150.33817 313.28444
7385.0000 -152.11518 -149.53468 2.58050 1.76094 -150.01149 333.90701
7390.0000 -152.38227 -149.94264 2.43963 1.75670 -150.07642 328.54882
7395.0000 -152.25046 -149.54982 2.70064 1.76303 -149.97948 335.61891
7400.0000 -152.68261 -150.33476 2.34785 1.75664 -150.07735 331.10913
7405.0000 -152.65698 -149.91655 2.74042 1.76042 -150.01944 333.81555
7410.0000 -152.51708 -149.95292 2.56416 1.76585 -149.93629 341.78672
7415.0000 -152.68784 -150.36200 2.32583 1.73434 -150.41923 313.26376
7420.0000 -152.80948 -150.07739 2.73208 1.75822 -150.05317 335.12591
7425.0000 -152.77530 -150.41300 2.36230 1.75035 -150.17374 322.73844
7430.0000 -152.65796 -149.50009 3.15787 1.73137 -150.46469 308.53660
7435.0000 -152.52355 -149.20057 3.32298 1.78853 -149.58869 359.52237
7440.0000 -152.25930 -149.47081 2.78848 1.80667 -149.31063 378.87756
7445.0000 -152.64239 -149.91859 2.72380 1.76833 -149.89821 343.26206
7450.0000 -152.45671 -149.70912 2.74759 1.76875 -149.89174 345.53376
7455.0000 -152.75094 -150.09021 2.66074 1.75067 -150.16897 323.51062
7460.0000 -152.55163 -150.49757 2.05405 1.73596 -150.39442 311.62638
7465.0000 -153.04961 -150.35888 2.69073 1.73522 -150.40564 312.73418
7470.0000 -152.28035 -150.07471 2.20564 1.75534 -150.09740 327.97961
7475.0000 -152.46765 -149.95345 2.51420 1.76541 -149.94307 339.83942
7480.0000 -152.47558 -150.09203 2.38355 1.75115 -150.16155 324.16509
7485.0000 -152.48447 -150.05040 2.43407 1.75496 -150.10318 328.75963
7490.0000 -152.38865 -150.03490 2.35375 1.76668 -149.92346 338.74245
7495.0000 -152.39183 -150.06202 2.32980 1.76206 -149.99430 333.84939
7500.0000 -152.11578 -149.18451 2.93127 1.79206 -149.53453 361.55660
FREEZING PROCESS: loop number 31 T-loop= 306.00000000000000
main_MD> interactions number 31 at Temperature= 306.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.44422 1.00701 0.46813
force_rgl> df(natom) -3.31293 0.46557 -0.48610
7505.0000 -153.04185 -150.57218 2.46967 1.75464 -150.10800 313.21992
7510.0000 -152.76189 -150.42810 2.33380 1.74088 -150.31898 303.16209
7515.0000 -152.70587 -150.61634 2.08953 1.72118 -150.62084 296.05173
7520.0000 -152.65367 -150.28820 2.36547 1.72839 -150.51036 300.97711
7525.0000 -153.13167 -150.37502 2.75665 1.74215 -150.29945 316.83322
7530.0000 -152.55750 -150.18514 2.37236 1.73383 -150.42699 307.09572
7535.0000 -152.84643 -150.56343 2.28300 1.73963 -150.33814 314.92260
7540.0000 -152.95143 -150.34347 2.60796 1.73187 -150.45708 309.33588
7545.0000 -153.09138 -150.56630 2.52508 1.73278 -150.44313 305.60622
7550.0000 -153.09542 -150.34804 2.74738 1.72092 -150.62486 290.94270
7555.0000 -152.80146 -150.23772 2.56373 1.75838 -150.05074 330.59714
7560.0000 -152.65151 -149.89338 2.75814 1.77117 -149.85467 342.27054
7565.0000 -152.33281 -149.89962 2.43319 1.75263 -150.13885 325.07990
7570.0000 -152.44663 -149.85616 2.59047 1.74990 -150.18068 323.14850
7575.0000 -153.07660 -150.27895 2.79765 1.76117 -150.00792 332.38938
7580.0000 -152.89893 -150.55558 2.34335 1.71289 -150.74796 297.27580
7585.0000 -152.65705 -150.03471 2.62233 1.74274 -150.29039 319.68502
7590.0000 -152.86949 -150.08410 2.78539 1.75486 -150.10470 330.24128
7595.0000 -153.17886 -151.00825 2.17061 1.72920 -150.49802 305.41101
7600.0000 -152.96616 -150.80347 2.16269 1.70229 -150.91041 279.14740
7605.0000 -152.53787 -150.14260 2.39526 1.73909 -150.34640 314.55637
7610.0000 -152.92532 -150.72437 2.20095 1.74095 -150.31786 316.67980
7615.0000 -152.67830 -150.12744 2.55086 1.71555 -150.70722 291.29582
7620.0000 -153.41868 -151.21523 2.20344 1.72228 -150.60398 302.87621
7625.0000 -153.21703 -150.97988 2.23715 1.69421 -151.03415 271.92087
7630.0000 -152.81396 -150.36475 2.44921 1.71902 -150.65400 297.71403
7635.0000 -153.12288 -150.79586 2.32702 1.71821 -150.66633 296.30669
7640.0000 -152.93320 -150.47969 2.45351 1.71030 -150.78758 286.45806
7645.0000 -153.00658 -150.80412 2.20246 1.72631 -150.54217 303.86432
7650.0000 -152.84901 -150.29624 2.55277 1.72328 -150.58873 299.57129
7655.0000 -152.65460 -150.36462 2.28998 1.75031 -150.17440 322.79875
7660.0000 -153.09845 -150.55802 2.54043 1.74836 -150.20427 321.52803
7665.0000 -152.86124 -150.47551 2.38573 1.72152 -150.61563 295.84941
7670.0000 -153.02675 -150.87511 2.15164 1.71859 -150.66057 295.84143
7675.0000 -153.04528 -150.72620 2.31908 1.71079 -150.78013 287.49098
7680.0000 -152.85264 -150.32884 2.52380 1.71894 -150.65526 296.14284
7685.0000 -152.71070 -149.96933 2.74137 1.76115 -150.00833 336.93572
7690.0000 -152.66899 -150.09370 2.57529 1.74183 -150.30439 314.60578
7695.0000 -152.78681 -150.44450 2.34231 1.73750 -150.37078 310.55812
7700.0000 -152.83601 -150.34513 2.49088 1.74358 -150.27752 320.54570
7705.0000 -152.83381 -150.58937 2.24444 1.73529 -150.40458 309.80589
7710.0000 -153.12145 -150.59842 2.52303 1.72865 -150.50643 308.61947
7715.0000 -152.98230 -150.56063 2.42167 1.73272 -150.44406 314.34637
7720.0000 -152.85510 -150.07960 2.77550 1.74301 -150.28631 317.66703
7725.0000 -153.05771 -150.81317 2.24454 1.72711 -150.53001 301.07516
7730.0000 -152.56088 -150.31365 2.24723 1.73730 -150.37384 312.11717
7735.0000 -153.07612 -150.68441 2.39171 1.72396 -150.57826 299.76352
7740.0000 -153.14938 -150.65580 2.49358 1.72502 -150.56197 301.40095
7745.0000 -152.55636 -150.56687 1.98949 1.72716 -150.52928 302.10818
7750.0000 -153.01639 -150.99791 2.01848 1.72244 -150.60154 298.93532
main_MD> EXECUTION TIME: 0 [day], 0 [hour], 11 [min], 48.9370863 [s].
main_MD> Deallocating global variables
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